SCHEMBL29202467

SCHEMBL29202467

OCCCC#Cc1cc(O)ccc1Br

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ CYP2C9 P11712 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ PGK1 P00558 2/20 0.35
▸ HTR2C P28335 1/20 0.33
▸ HTR2B P41595 1/20 0.33
▸ BACE1 P56817 1/20 0.31
▸ MAPK14 Q16539 1/20 0.31
▸ GABRP O00591 1/20 0.31
▸ GABRD O14764 1/20 0.31
▸ GABRA1 P14867 1/20 0.31
▸ GABRB1 P18505 1/20 0.31
▸ GABRG2 P18507 1/20 0.31
▸ GABRB3 P28472 1/20 0.31
▸ GABRA5 P31644 1/20 0.31
▸ GABRA3 P34903 1/20 0.31

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
SCHEMBL24892482 0.82 KDM4E (0.47) KDM4EALDH1A1CYP1A2CYP3A4MAPT
SCHEMBL21114150 0.77 CYP3A4 (0.57) KDM4EALDH1A1CYP1A2CYP3A4MAPT
SCHEMBL2797723 0.73 KDM4E (0.50) KDM4EALDH1A1CYP1A2CYP3A4MAPT
SCHEMBL22075510 0.71 PGK1 (0.38) KDM4EALDH1A1CYP1A2CYP3A4MAPT
SCHEMBL30211607 0.70 KDM4E (0.34) KDM4EALDH1A1CYP1A2CYP3A4MAPT
SCHEMBL29202433 0.70 KDM4E (0.34) KDM4EALDH1A1CYP1A2CYP3A4MAPT
SCHEMBL2180477 0.70 CYP3A4 (0.67) KDM4EALDH1A1CYP1A2CYP3A4MAPT
SCHEMBL6791668 0.70 ALDH1A1 (0.41) KDM4EALDH1A1CYP1A2CYP3A4MAPT
SCHEMBL1875968 0.69 GABRP (0.41) KDM4EALDH1A1CYP1A2CYP3A4MAPT
SCHEMBL2799266 0.69 KDM4E (0.43) KDM4EALDH1A1CYP1A2CYP3A4MAPT

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4370130-A1 THERAPEUTIC COMPOUNDS AND METHODS Genentech, Inc. (US) 2024-05-22 — — EP disclosed
CN-117642170-A Therapeutic compounds and methods 基因泰克公司 2024-03-01 — — CN disclosed
WO-2023287793-A1 THERAPEUTIC COMPOUNDS AND METHODS GENENTECH, INC. (US) 2023-01-19 — — WO disclosed
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