SCHEMBL7901722

SCHEMBL7901722

C=Cc1cccc(OCc2ccc(CO)cc2)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 10/20 0.53
MAOA P21397 9/20 0.53
TSHR P16473 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
NPC1 O15118 1/20 0.51
RAB9A P51151 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
LCK P06239 1/20 0.50
KDM4E B2RXH2 1/20 0.50
ALDH1A1 P00352 1/20 0.50
PKM P14618 1/20 0.50
CCNB2 O95067 1/20 0.48
CDK1 P06493 1/20 0.48
CDK4 P11802 1/20 0.48
CCNB1 P14635 1/20 0.48
CCND1 P24385 1/20 0.48
CCNB3 Q8WWL7 1/20 0.48
APP P05067 1/20 0.46
CYP4F2 P78329 1/20 0.46
CYP4A11 Q02928 1/20 0.46

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
SCHEMBL2265668 0.85 MAOB (0.71) MAOBMAOALCKKDM4EALDH1A1
SCHEMBL11903271 0.84 MAOB (0.61) MAOBMAOANPC1RAB9ATDP1
SCHEMBL3241768 0.80 NPC1 (0.47) SMN1; SMN2NPC1RAB9AKDM4EALDH1A1
SCHEMBL21906201 0.80 MAOA (0.72) MAOBMAOANPC1RAB9ATDP1
SCHEMBL29640437 0.80 MAOA (0.72) MAOBMAOANPC1RAB9ATDP1
SCHEMBL28207056 0.80 TDP1 (0.44) MAOBMAOATSHRSMN1; SMN2NPC1
SCHEMBL439247 0.78 SMN1; SMN2 (0.43) MAOBTSHRSMN1; SMN2NPC1RAB9A
SCHEMBL4764468 0.77 ALDH1A1 (0.52) MAOBMAOASMN1; SMN2NPC1RAB9A
SCHEMBL7628720 0.76 SMN1; SMN2 (0.42) TSHRSMN1; SMN2NPC1RAB9ALCK
SCHEMBL29799252 0.76 LCK (0.58) MAOBMAOALCKKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6197905-B1 VINYL ETHER CHAIN TRANSFER AGENT TERMINATES THE GROWTH OF THE POLYMER CHAIN BY ADDITION TO THE PROPAGATING POLYMER RADICAL FOLLOWED BY EXPULSION OF A RADICAL WHICH THEN INITIATES ANOTHER POLYMER CHAIN COMMONWEALTH SCIENTIFIC & INDUSTRIAL RESARCH ORGANIZATION (AU) 2001-03-06 US disclosed