SCHEMBL7348302

SCHEMBL7348302

COc1cc(Br)cc2ccoc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.49
PIM1 P11309 1/20 0.47
ALDH1A1 P00352 4/20 0.46
CYP3A4 P08684 2/20 0.46
LMNA P02545 2/20 0.46
HPGD P15428 2/20 0.46
KDM4E B2RXH2 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
HSD17B10 Q99714 1/20 0.46
RXFP1 Q9HBX9 2/20 0.42
TP53 P04637 2/20 0.42
TSHR P16473 3/20 0.41
MAPK1 P28482 2/20 0.41
MAOA P21397 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2A6 P11509 1/20 0.41
ACHE P22303 1/20 0.41
PDE4A P27815 1/20 0.41
CYP2C19 P33261 1/20 0.41

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
SCHEMBL7483940 0.79 KDM4E (0.47) MAOBALDH1A1CYP3A4LMNAHPGD
SCHEMBL806505 0.79 ALDH1A1 (0.47) MAOBALDH1A1CYP3A4LMNAHPGD
SCHEMBL119906 0.79 CYP3A4 (0.47) MAOBALDH1A1CYP3A4LMNAHPGD
SCHEMBL5686671 0.79 CYP3A4 (0.44) MAOBALDH1A1CYP3A4LMNAHPGD
SCHEMBL29678611 0.78 CA12 (0.33) MAOBPIM1ALDH1A1CYP3A4LMNA
SCHEMBL16234789 0.78 ALDH1A1 (0.46) MAOBALDH1A1CYP3A4LMNAHPGD
SCHEMBL28217067 0.77 HRH4 (0.34) MAOBMAOA
SCHEMBL18530968 0.75 ELANE (0.34) MAOBPIM1ALDH1A1CYP3A4LMNA
SCHEMBL7487069 0.75 MAOB (0.38) MAOBCYP3A4LMNAHPGDKDM4E
SCHEMBL16426152 0.74 GPR35 (0.37) MAOBALDH1A1CYP3A4LMNAHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114761410-B Pyrrolopyrimidinone compounds and application thereof 广州必贝特医药股份有限公司 2023-08-25 CN disclosed
WO-2022213932-A1 PYRROLOPYRIMIDINONE COMPOUND AND APPLICATION THEREOF 广州必贝特医药股份有限公司 2022-10-13 WO disclosed
CN-114761410-A Pyrrolopyrimidinone compounds and application thereof 广州必贝特医药股份有限公司 2022-07-15 CN disclosed
EP-0834508-B1 Substituted biphenyl or phenylpyridine derivatives, process for their preparation and pharmaceutical compositions containing them ADIR (FR) 2001-08-16 EP disclosed
US-5877190-A PHOSPHODIESTERASE INHIBITOR ADIR ET COMPAGNIE (FR) 1999-03-02 US disclosed
EP-0834508-A1 Substituted biphenyl or phenylpyridine derivatives, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1998-04-08 EP disclosed