SCHEMBL904471

SCHEMBL904471

O=Cc1ccc(OBOc2ccc(C=O)nc2)cn1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNJ1 P48048 1/20 0.38
CCR1 P32246 1/20 0.34
TUBB4A P04350 1/20 0.33
TUBB P07437 1/20 0.33
TUBA3C P0DPH7 1/20 0.33
TUBA1B P68363 1/20 0.33
TUBA4A P68366 1/20 0.33
TUBB4B P68371 1/20 0.33
TUBB3 Q13509 1/20 0.33
TUBB2A Q13885 1/20 0.33
TUBB8 Q3ZCM7 1/20 0.33
TUBA3E Q6PEY2 1/20 0.33
TUBA1A Q71U36 1/20 0.33
TUBA1C Q9BQE3 1/20 0.33
TUBB6 Q9BUF5 1/20 0.33
TUBB2B Q9BVA1 1/20 0.33
TUBB1 Q9H4B7 1/20 0.33
KDM4E B2RXH2 3/20 0.32
ALDH1A1 P00352 3/20 0.32
MAPT P10636 2/20 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
SCHEMBL733531 0.78 TUBB4A (0.51) KCNJ1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL252784 0.74 GAA (0.39) KCNJ1ALDH1A1MAPTLMNASMN1; SMN2
SCHEMBL934205 0.74 NQO1 (0.48) KDM4EALDH1A1LMNASMN1; SMN2
SCHEMBL31621333 0.73 ALDH1A1 (0.53) KCNJ1KDM4EALDH1A1MAPTLMNA
SCHEMBL102267 0.73 ALDH1A3 (0.53) KCNJ1ALDH1A1SMN1; SMN2
SCHEMBL31141577 0.73 KCNJ1 (0.36) KCNJ1CCR1TUBB4ATUBBTUBA3C
SCHEMBL12721565 0.73 NPC1 (0.39) KCNJ1L3MBTL1
SCHEMBL20489794 0.73 DRD1 (0.49) KCNJ1CCR1KDM4EALDH1A1LMNA
SCHEMBL31174798 0.73 NPC1 (0.39) KCNJ1L3MBTL1
SCHEMBL510017 0.73 LTA4H (0.44) KDM4EALDH1A1LMNASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250170138-A1 ARYL-OR HETEROARYL-SUBSTITUTED BENZENE COMPOUNDS Epizyme, Inc. 2025-05-29 US disclosed
US-12168015-B2 Aryl-or heteroaryl-substituted benzene compounds Epizyme, Inc. (US) 2024-12-17 US disclosed
US-12168016-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-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
EP-4360712-A2 ARYL- OR HETEROARYL-SUBSTITUTED BENZENE COMPOUNDS Epizyme, Inc. (US) 2024-05-01 EP disclosed
EP-3943485-B1 ARYL- OR HETEROARYL-SUBSTITUTED BENZENE COMPOUNDS EPIZYME INC (US) 2023-12-27 EP disclosed
EP-3943485-A1 ARYL- OR HETEROARYL-SUBSTITUTED BENZENE COMPOUNDS Epizyme, Inc. (US) 2022-01-26 EP disclosed
US-9090562-B2 Aryl- or heteroaryl-substituted benzene compounds Epizyme, Inc. (US) 2015-07-28 US disclosed
US-9040572-B2 Method of preparing benzoimidazole derivatives DAEWOONG PHARMACEUTICAL CO., LTD. (KR) 2015-05-26 US disclosed
US-20140288041-A1 Aryl- or Heteroaryl-Substituted Benzene Compounds Epizyme, Inc. (US) 2014-09-25 US disclosed
US-8765732-B2 Aryl- or heteroaryl-substituted benzene compounds Epizyme, Inc. (US) 2014-07-01 US disclosed
EP-2697199-A1 ARYL-OR HETEROARYL-SUBSTITUTED BENZENE COMPOUNDS Epizyme, Inc. (US) 2014-02-19 EP disclosed
US-20130231477-A1 NOVEL METHOD OF PREPARING BENZOIMIDAZOLE DERIVATIVES DAEWOONG PHARMACEUTICAL CO., LTD. (KR) 2013-09-05 US disclosed
EP-2621915-A2 NOVEL METHOD OF PREPARING BENZOIMIDAZOLE DERIVATIVES Daewoong Pharmaceutical Co., Ltd (KR) 2013-08-07 EP disclosed
US-20130123234-A1 Aryl- or Heteroaryl-Substituted Benzene Compounds EISAI R&D MANAGEMENT CO., LTD. (JP) 2013-05-16 US disclosed
WO-2012142504-A1 ARYL-OR HETEROARYL-SUBSTITUTED BENZENE COMPOUNDS Epizyme, Inc. (US) 2012-10-18 WO disclosed
WO-2012044043-A2 NOVEL METHOD OF PREPARING BENZOIMIDAZOLE DERIVATIVES DAEWOONG PHARMACEUTICAL CO., LTD. (KR) 2012-04-05 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 (10 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 KCNJ1 1158/4885CCR1 831/4885TUBB4A 1792/4885
US-20240245698-A1 ARYL-OR HETEROARYL-SUBSTITUTED BENZENE COMPOUNDS AHR, ARNT, CYP1B1 KCNJ1 1158/4885CCR1 831/4885TUBB4A 1792/4885
US-20240277723-A1 ARYL-OR HETEROARYL-SUBSTITUTED BENZENE COMPOUNDS AHR, ARNT, CYP1B1 KCNJ1 1158/4885CCR1 831/4885TUBB4A 1792/4885
US-12161645-B2 Aryl-or heteroaryl-substituted benzene compounds AHR, ARNT, CYP1B1 KCNJ1 1158/4885CCR1 831/4885TUBB4A 1792/4885
US-20250170138-A1 ARYL-OR HETEROARYL-SUBSTITUTED BENZENE COMPOUNDS AHR, ARNT, CYP1B1 KCNJ1 1158/4885CCR1 831/4885TUBB4A 1792/4885
US-20240245697-A1 ARYL-OR HETEROARYL-SUBSTITUTED BENZENE COMPOUNDS AHR, ARNT, CYP1B1 KCNJ1 1158/4885CCR1 831/4885TUBB4A 1792/4885
US-20140288041-A1 Aryl- or Heteroaryl-Substituted Benzene Compounds AHR, ARNT, CYP1B1 KCNJ1 1158/4885CCR1 831/4885TUBB4A 1792/4885
US-20130231477-A1 NOVEL METHOD OF PREPARING BENZOIMIDAZOLE DERIVATIVES BRD1, BRD4, VAT1 KCNJ1 73/4885CCR1 3598/4885TUBB4A 2857/4885
US-20130123234-A1 Aryl- or Heteroaryl-Substituted Benzene Compounds AHR, ARNT, CYP1B1 KCNJ1 1158/4885CCR1 831/4885TUBB4A 1792/4885
US-12168015-B2 Aryl-or heteroaryl-substituted benzene compounds AHR, ARNT, CYP1B1 KCNJ1 1158/4885CCR1 831/4885TUBB4A 1792/4885

“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.