SCHEMBL10574269

SCHEMBL10574269

COc1ccc(-c2nc3cc(C(C)(C)CNC=O)ccc3[nH]2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 5/20 0.48
▸ SMN1; SMN2 Q16637 4/20 0.48
▸ RAB9A P51151 4/20 0.48
▸ ALDH1A1 P00352 3/20 0.48
▸ PKM P14618 2/20 0.48
▸ KDM4E B2RXH2 2/20 0.48
▸ SLC2A1 P11166 1/20 0.46
▸ MEN1 O00255 2/20 0.43
▸ LMNA P02545 2/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ TRPV1 Q8NER1 2/20 0.43
▸ NFKB1 P19838 2/20 0.43
▸ NFKB2 Q00653 2/20 0.43
▸ RELA Q04206 2/20 0.43
▸ GAA P10253 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ STAT1 P42224 1/20 0.43
▸ HTT P42858 1/20 0.43
▸ NPBWR1 P48145 1/20 0.43

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
SCHEMBL10574279 0.92 SLC2A1 (0.55) NPC1SMN1; SMN2RAB9AALDH1A1PKM
SCHEMBL10580688 0.89 HDAC6 (0.52) SMN1; SMN2TRPV1MAPTNPBWR1TP53
SCHEMBL10574665 0.88 NPBWR1 (0.47) NPC1SMN1; SMN2RAB9AALDH1A1KDM4E
SCHEMBL10576075 0.88 ALOX5 (0.47) ALDH1A1KDM4EMEN1KMT2AMAPT
SCHEMBL10577985 0.87 NPBWR1 (0.46) RAB9ATRPV1NPBWR1CHEK2HDAC6
SCHEMBL10578691 0.87 GUSB (0.43) NPC1SMN1; SMN2RAB9AALDH1A1PKM
SCHEMBL10577324 0.87 DGAT1 (0.46) SMN1; SMN2TRPV1MAPTNPBWR1CHEK2
SCHEMBL10578441 0.87 HDAC6 (0.46) NPC1SMN1; SMN2RAB9AALDH1A1KDM4E
SCHEMBL10574083 0.86 LOXL2 (0.39) NPC1RAB9AALDH1A1PKMKDM4E
SCHEMBL10574691 0.86 KDM4E (0.43) NPC1SMN1; SMN2RAB9AALDH1A1KDM4E

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-0264109-A1 Platinum complex, process for preparing same and antitumor agent TORAY INDUSTRIES, INC. (JP) 1988-04-20 — — EP claimed
US-4882342-A CARDIOVASCULAR DISORDERS BOEHRINGER MANNHEIM GMBH (DE) 1989-11-21 — — US disclosed
EP-0266558-A2 5-Alkylbenzimidazoles, process for their preparation and medicaments containing them Roche Diagnostics GmbH (DE) 1988-05-11 — — EP disclosed
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