SCHEMBL12499900

SCHEMBL12499900

Cc1cc(C=O)ccc1B1OC(C)(C)C(C)(C)O1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.38
ALDH1A3 P47895 2/20 0.38
TDP1 Q9NUW8 2/20 0.36
HSD17B10 Q99714 1/20 0.36
CYP2A6 P11509 2/20 0.35
P4HB P07237 1/20 0.35
KDM4E B2RXH2 2/20 0.33
RAB9A P51151 2/20 0.33
HPGD P15428 2/20 0.33
TSHR P16473 1/20 0.33
MEN1 O00255 1/20 0.33
NPC1 O15118 1/20 0.33
POLB P06746 1/20 0.33
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33
PTK2B Q14289 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PTGS2 P35354 1/20 0.32
JAK2 O60674 3/20 0.32
BTK Q06187 3/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL29976409 1.00 ALDH1A1 (0.38) ALDH1A1ALDH1A3TDP1HSD17B10CYP2A6
SCHEMBL1467753 0.88 CYP2A6 (0.36) ALDH1A1ALDH1A3TDP1HSD17B10CYP2A6
SCHEMBL19211659 0.82 ALDH1A1 (0.37) ALDH1A1TDP1HSD17B10CYP2A6P4HB
SCHEMBL28698510 0.82 ALDH1A1 (0.47) ALDH1A1ALDH1A3TDP1HSD17B10CYP2A6
SCHEMBL29820394 0.82 ALDH1A1 (0.37) ALDH1A1TDP1HSD17B10CYP2A6P4HB
SCHEMBL31584071 0.82 ALDH1A1 (0.47) ALDH1A1ALDH1A3TDP1HSD17B10CYP2A6
SCHEMBL28476218 0.81 ALDH1A1 (0.37) ALDH1A1ALDH1A3TDP1HSD17B10CYP2A6
SCHEMBL21358544 0.81 LPL (0.35) ALDH1A1ALDH1A3TDP1HSD17B10P4HB
SCHEMBL24107274 0.80 LPL (0.38) ALDH1A1TDP1HSD17B10CYP2A6P4HB
SCHEMBL31533278 0.80 LPL (0.38) ALDH1A1TDP1HSD17B10CYP2A6P4HB

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 85 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12503473-B2 Triazolopyrimidine compounds and their use in treating cancer DIZAL (JIANGSU) PHARMACEUTICAL CO., LTD. (CN) 2025-12-23 US disclosed
US-20250170138-A1 ARYL-OR HETEROARYL-SUBSTITUTED BENZENE COMPOUNDS Epizyme, Inc. 2025-05-29 US disclosed
US-12168016-B2 Aryl-OR heteroaryl-substituted benzene compounds Epizyme, Inc. (US) 2024-12-17 US disclosed
US-12168015-B2 Aryl-or heteroaryl-substituted benzene compounds Epizyme, Inc. (US) 2024-12-17 US disclosed
US-12161645-B2 Aryl-or heteroaryl-substituted benzene compounds Epizyme, Inc. (US) 2024-12-10 US disclosed
US-20240287076-A1 COMPOUNDS FOR TARGETING DEGRADATION OF BRUTON'S TYROSINE KINASE C4 THERAPEUTICS, INC. 2024-08-29 US disclosed
US-20240277723-A1 ARYL-OR HETEROARYL-SUBSTITUTED BENZENE COMPOUNDS Epizyme, Inc. 2024-08-22 US disclosed
US-20240245698-A1 ARYL-OR HETEROARYL-SUBSTITUTED BENZENE COMPOUNDS Epizyme, Inc. 2024-07-25 US disclosed
US-20240245697-A1 ARYL-OR HETEROARYL-SUBSTITUTED BENZENE COMPOUNDS Epizyme, Inc. 2024-07-25 US disclosed
US-20240217980-A1 TRIAZOLOPYRIMIDINE COMPOUNDS AND THEIR USE IN TREATING CANCER DIZAL (JIANGSU) PHARMACEUTICAL CO., LTD. (CN) 2024-07-04 US disclosed
US-20140057891-A1 Substituted 6,5-Fused Bicyclic Heteroaryl Compounds Epizyme, Inc. (US) 2014-02-27 US disclosed
EP-2697199-A1 ARYL-OR HETEROARYL-SUBSTITUTED BENZENE COMPOUNDS Epizyme, Inc. (US) 2014-02-19 EP disclosed
EP-2681216-A2 SUBSTITUTED 6,5-FUSED BICYCLIC HETEROARYL COMPOUNDS Epizyme, Inc. (US) 2014-01-08 EP disclosed
US-8598167-B1 Substituted 6,5-fused bicyclic heteroaryl compounds Epizyme, Inc. (US) 2013-12-03 US disclosed
US-20130317026-A1 SUBSTITUTED 6,5-FUSED BICYCLIC HETEROARYL COMPOUNDS Epizyme, Inc. (US) 2013-11-28 US disclosed
US-20130123234-A1 Aryl- or Heteroaryl-Substituted Benzene Compounds EISAI R&D MANAGEMENT CO., LTD. (JP) 2013-05-16 US disclosed
US-8410088-B2 Aryl- or heteroaryl-substituted benzene compounds Epizyme, Inc. (US) 2013-04-02 US disclosed
US-20120264734-A1 Aryl- or Heteroaryl-Substituted Benzene Compounds Epizyme, Inc. 2012-10-18 US disclosed
WO-2012142504-A1 ARYL-OR HETEROARYL-SUBSTITUTED BENZENE COMPOUNDS Epizyme, Inc. (US) 2012-10-18 WO disclosed
WO-2012118812-A2 SUBSTITUTED 6,5-FUSED BICYCLIC HETEROARYL COMPOUNDS Epizyme, Inc. (US) 2012-09-07 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (14 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-12168016-B2 Aryl-OR heteroaryl-substituted benzene compounds AHR, ARNT, CYP1B1 ALDH1A1 324/4885ALDH1A3 1725/4885TDP1 2005/4885
US-20240245698-A1 ARYL-OR HETEROARYL-SUBSTITUTED BENZENE COMPOUNDS AHR, ARNT, CYP1B1 ALDH1A1 324/4885ALDH1A3 1725/4885TDP1 2005/4885
US-12503473-B2 Triazolopyrimidine compounds and their use in treating cancer ABCC4, ABCB1, SLC16A3 ALDH1A1 205/4885ALDH1A3 1198/4885TDP1 818/4885
US-20240277723-A1 ARYL-OR HETEROARYL-SUBSTITUTED BENZENE COMPOUNDS AHR, ARNT, CYP1B1 ALDH1A1 324/4885ALDH1A3 1725/4885TDP1 2005/4885
US-20140057891-A1 Substituted 6,5-Fused Bicyclic Heteroaryl Compounds CYP3A5, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, CYP2D6 ALDH1A1 470/4885ALDH1A3 1838/4885TDP1 2377/4885
US-12161645-B2 Aryl-or heteroaryl-substituted benzene compounds AHR, ARNT, CYP1B1 ALDH1A1 324/4885ALDH1A3 1725/4885TDP1 2005/4885
US-20250170138-A1 ARYL-OR HETEROARYL-SUBSTITUTED BENZENE COMPOUNDS AHR, ARNT, CYP1B1 ALDH1A1 324/4885ALDH1A3 1725/4885TDP1 2005/4885
US-20120264734-A1 Aryl- or Heteroaryl-Substituted Benzene Compounds AHR, ARNT, CYP1B1 ALDH1A1 324/4885ALDH1A3 1725/4885TDP1 2005/4885
US-20240217980-A1 TRIAZOLOPYRIMIDINE COMPOUNDS AND THEIR USE IN TREATING CANCER ABCC4, ABCB1, SLC16A3 ALDH1A1 205/4885ALDH1A3 1198/4885TDP1 818/4885
US-20240245697-A1 ARYL-OR HETEROARYL-SUBSTITUTED BENZENE COMPOUNDS AHR, ARNT, CYP1B1 ALDH1A1 324/4885ALDH1A3 1725/4885TDP1 2005/4885
US-20240287076-A1 COMPOUNDS FOR TARGETING DEGRADATION OF BRUTON'S TYROSINE KINASE BTK, SYK, LYN ALDH1A1 3476/4885ALDH1A3 4268/4885TDP1 961/4885
US-20130317026-A1 SUBSTITUTED 6,5-FUSED BICYCLIC HETEROARYL COMPOUNDS CYP3A5, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, CYP2D6 ALDH1A1 470/4885ALDH1A3 1838/4885TDP1 2377/4885
US-20130123234-A1 Aryl- or Heteroaryl-Substituted Benzene Compounds AHR, ARNT, CYP1B1 ALDH1A1 324/4885ALDH1A3 1725/4885TDP1 2005/4885
US-12168015-B2 Aryl-or heteroaryl-substituted benzene compounds AHR, ARNT, CYP1B1 ALDH1A1 324/4885ALDH1A3 1725/4885TDP1 2005/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.