SCHEMBL10010909

SCHEMBL10010909

Cc1cc(C)c(-c2cccc3nc4ccccc4cc23)c(C)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.49
HPGD P15428 3/20 0.49
GLA P06280 2/20 0.49
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
KMT2A Q03164 2/20 0.49
KDM4E B2RXH2 2/20 0.49
GAA P10253 2/20 0.49
LMNA P02545 1/20 0.49
POLB P06746 1/20 0.49
PTBP1 P26599 1/20 0.49
RCE1 Q9Y256 1/20 0.49
MAPT P10636 1/20 0.44
ACHE P22303 1/20 0.44
PDE10A Q9Y233 1/20 0.44
CRHR1 P34998 5/20 0.43
MBNL1 Q9NR56 1/20 0.43
TDP1 Q9NUW8 1/20 0.42
PSMB5 P28074 1/20 0.42
CYP1A2 P05177 3/20 0.42

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
SCHEMBL29664592 1.00 ALDH1A1 (0.49) ALDH1A1HPGDGLANPC1RAB9A
SCHEMBL3908670 0.88 NQO2 (0.47) ALDH1A1HPGDGLANPC1RAB9A
SCHEMBL28229302 0.81 ALDH1A1 (0.53) ALDH1A1HPGDGLANPC1RAB9A
SCHEMBL7126854 0.81 ALDH1A1 (0.46) ALDH1A1HPGDGLANPC1RAB9A
SCHEMBL27961756 0.81 ALDH1A1 (0.56) ALDH1A1HPGDGLANPC1RAB9A
SCHEMBL4014126 0.80 KMT2A (0.64) ALDH1A1HPGDGLANPC1RAB9A
SCHEMBL20609436 0.79 CYP2A6 (0.55) ALDH1A1HPGDKDM4EGAACRHR1
SCHEMBL29376451 0.77 ALDH1A1 (0.60) ALDH1A1HPGDGLANPC1RAB9A
SCHEMBL291182 0.77 ALDH1A1 (0.60) ALDH1A1HPGDGLANPC1RAB9A
SCHEMBL1187275 0.75 ALDH1A1 (0.58) ALDH1A1HPGDGLANPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116655590-A Conjugated polyene compound and preparation method thereof 东北师范大学 2023-08-29 CN claimed
CN-115093346-A Method for preparing nitrile compounds from different substituted cycloalkanones in one step 西安交通大学 2022-09-23 CN claimed
US-12534437-B2 Photoredox-catalyzed direct C—H functionalization of arenes THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2026-01-27 US disclosed
US-20250250691-A1 CONTINUOUS FLOW REACTION DEVICE FOR AN ELECTROCHEMICAL PROCESS CREAFLOW BV (BE) 2025-08-07 US disclosed
US-20250188117-A1 C-Terminal Peptide Modification TECHNISCHE UNIVERSITEIT DELFT (NL) 2025-06-12 US disclosed
US-12312361-B2 Methods for practical synthesis of deuterated amino acids ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) 2025-05-27 US disclosed
EP-4508261-A1 CONTINUOUS FLOW REACTION DEVICE FOR AN ELECTROCHEMICAL PROCESS Creaflow BV (BE) 2025-02-19 EP disclosed
US-20240199686-A1 C-Terminal Peptide Modification TECHNISCHE UNIVERSITEIT DELFT (NL) 2024-06-20 US disclosed
WO-2024085386-A1 ALKYNYL AMINO ACID ESTER DERIVATIVE PREPARATION METHOD USING PHOTOCATALYTIC REACTION, AND USES THEREOF 한국과학기술연구원 2024-04-25 WO disclosed
EP-4314007-A1 C-TERMINAL PEPTIDE MODIFICATION Technische Universiteit Delft (NL) 2024-02-07 EP disclosed
EP-4308582-A1 C-TERMINAL PEPTIDE MODIFICATION Technische Universiteit Delft (NL) 2024-01-24 EP disclosed
CN-115093346-A Method for preparing nitrile compounds from different substituted cycloalkanones in one step 西安交通大学 2022-09-23 CN disclosed
WO-2022197184-A1 C-TERMINAL PEPTIDE MODIFICATION TECHNISCHE UNIVERSITEIT DELFT (NL) 2022-09-22 WO disclosed
WO-2021158781-A1 METHODS FOR PRACTICAL SYNTHESIS OF DEUTERATED AMINO ACIDS ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) 2021-08-12 WO disclosed
US-10399947-B2 Photoredox-catalyzed direct C—H functionalization of arenes THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2019-09-03 US disclosed
US-20180148414-A1 PHOTOREDOX-CATALYZED DIRECT C-H FUNCTIONALIZATION OF ARENES THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL 2018-05-31 US disclosed
WO-2016196816-A1 PHOTOREDOX-CATALYZED DIRECT C-H FUNCTIONALIZATION OF ARENES THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2016-12-08 WO disclosed
EP-2479160-B1 PROCESS FOR PRODUCTION OF OXIDATION REACTION PRODUCT OF AROMATIC COMPOUND UNIV OSAKA (JP) 2015-09-09 EP disclosed
EP-2479160-A1 PROCESS FOR PRODUCTION OF OXIDATION REACTION PRODUCT OF AROMATIC COMPOUND Osaka University (JP) 2012-07-25 EP disclosed
US-20120171111-A1 PROCESS FOR PRODUCTION OF OXIDATION REACTION PRODUCT OF AROMATIC COMPOUND OSAKA UNIVERSITY (JP) 2012-07-05 US 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 (7 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-12312361-B2 Methods for practical synthesis of deuterated amino acids DAO, DDO, DDC ALDH1A1 2745/4885HPGD 953/4885GLA 2077/4885
US-20120171111-A1 PROCESS FOR PRODUCTION OF OXIDATION REACTION PRODUCT OF AROMATIC COMPOUND TYR, AOX1, POR ALDH1A1 557/4885HPGD 316/4885GLA 3809/4885
US-10399947-B2 Photoredox-catalyzed direct C—H functionalization of arenes PPOX, AOC2, AOC3 ALDH1A1 511/4885HPGD 544/4885GLA 4053/4885
US-12534437-B2 Photoredox-catalyzed direct C—H functionalization of arenes PF4, PPOX, AOC2 ALDH1A1 1939/4885HPGD 3799/4885GLA 4798/4885
US-20240199686-A1 C-Terminal Peptide Modification PTMS, NGLY1, QPCT ALDH1A1 4186/4885HPGD 4156/4885GLA 2254/4885
US-20250188117-A1 C-Terminal Peptide Modification PTMS, NGLY1, QPCT ALDH1A1 3987/4885HPGD 3916/4885GLA 1833/4885
US-20180148414-A1 PHOTOREDOX-CATALYZED DIRECT C-H FUNCTIONALIZATION OF ARENES PPOX, AOC2, AOC3 ALDH1A1 495/4885HPGD 475/4885GLA 4069/4885

“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.