SCHEMBL10465722

SCHEMBL10465722

O=[C]OCC(=O)c1ccc(Br)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 2/20 0.53
NPC1 O15118 1/20 0.53
HPGD P15428 1/20 0.53
RAB9A P51151 1/20 0.53
LMNA P02545 2/20 0.50
HDAC1 Q13547 2/20 0.50
HDAC8 Q9BY41 2/20 0.50
KDM4E B2RXH2 1/20 0.50
HDAC3 O15379 1/20 0.50
HDAC4 P56524 1/20 0.50
HDAC7 Q8WUI4 1/20 0.50
HDAC2 Q92769 1/20 0.50
HDAC10 Q969S8 1/20 0.50
HDAC11 Q96DB2 1/20 0.50
HDAC6 Q9UBN7 1/20 0.50
HDAC9 Q9UKV0 1/20 0.50
HDAC5 Q9UQL6 1/20 0.50
GAA P10253 2/20 0.49
KMT2A Q03164 2/20 0.49
MAPT P10636 2/20 0.45

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
SCHEMBL11074836 0.81 GSK3B (0.53) GSK3BNPC1HPGDRAB9ALMNA
SCHEMBL11450666 0.81 NPC1 (0.53) GSK3BNPC1HPGDRAB9ALMNA
SCHEMBL1282 0.80 MAPT (0.52) GSK3BNPC1HPGDRAB9ALMNA
SCHEMBL866784 0.79 GSK3B (0.61) GSK3BNPC1HPGDRAB9ALMNA
SCHEMBL773970 0.78 HDAC3 (0.58) GSK3BNPC1RAB9AHDAC1HDAC8
SCHEMBL11430930 0.78 GSK3B (0.59) GSK3BNPC1HPGDRAB9ALMNA
SCHEMBL11430934 0.76 GSK3B (0.57) GSK3BNPC1HPGDRAB9ALMNA
SCHEMBL11430938 0.76 GSK3B (0.57) GSK3BNPC1HPGDRAB9ALMNA
SCHEMBL11518309 0.75 GSK3B (0.57) GSK3BKDM4EKMT2AMAPTCES2
SCHEMBL11801259 0.73 RAB9A (0.62) GSK3BNPC1HPGDRAB9ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4051320-A PROCESS FOR PREPARING ALKOXYLATED DERIVATIVES OF CEPHALOSPORIN COMPOUNDS SANKYO COMPANY LIMITED (JA) 1977-09-27 US claimed
US-4933355-A ALDOSE REDUCTASE INHIBITORS SANKYO COMPANY LIMITED (JP) 1990-06-12 US disclosed
EP-0337819-A1 Thiazole derivatives, their preparation and their use in the treatment of diabetes complications Sankyo Company Limited (JP) 1989-10-18 EP disclosed
US-4438265-A Esters of 7-sulfenyliminocephem-4-carboxylic acids SANKYO COMPANY LIMITED (JP) 1984-03-20 US disclosed
US-4377591-A CARBAPENICILLIN ANTIBIOTICS SANKYO COMPANY, LIMITED (JP) 1983-03-22 US disclosed
US-4320137-A Derivatives of perhydro-aza-heterocycles CIBA-GEIGY CORPORATION (US) 1982-03-16 US disclosed
US-4247548-A 7α-Methoxycephalosporin derivatives and their pharmaceutical compositions having antibacterial activity SANKYO COMPANY LIMITED (JP) 1981-01-27 US disclosed
US-4162251-A Process for the preparation of β-lactam compounds SANKYO COMPANY LIMITED (JP) 1979-07-24 US disclosed
US-4160837-A ANTIDEPRESSANTS CIBA-GEIGY CORPORATION (US) 1979-07-10 US disclosed
US-4145344-A BICYCLOMYCIN DERIVATIVES CIBA-GEIGY CORPORATION (US) 1979-03-20 US disclosed
US-4051320-A PROCESS FOR PREPARING ALKOXYLATED DERIVATIVES OF CEPHALOSPORIN COMPOUNDS SANKYO COMPANY LIMITED (JA) 1977-09-27 US disclosed
US-4017488-A Process for preparing 7β-acylamino-7α-alkoxycephalosporins SANKYO COMPANY LIMITED (JA) 1977-04-12 US disclosed
US-3960845-A HALOGENATION SANKYO COMPANY LIMITED (JA) 1976-06-01 US disclosed