SCHEMBL9214261

SCHEMBL9214261

OB(O)c1cccc(C=Cc2cccc(B(O)O)c2)c1

nearest known ligand 0.69

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 7/20 0.69
TTR P02766 4/20 0.68
KDM4E B2RXH2 1/20 0.52
ALDH1A1 P00352 1/20 0.52
MGLL Q99685 2/20 0.50
NFE2L2 Q16236 2/20 0.50
CA4 P22748 1/20 0.46
CA6 P23280 1/20 0.46
CA5A P35218 1/20 0.46
CA7 P43166 1/20 0.46
CA14 Q9ULX7 1/20 0.46
CA5B Q9Y2D0 1/20 0.46
LCK P06239 1/20 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
SCHEMBL9214256 1.00 ENPP2 (0.69) ENPP2TTRKDM4EALDH1A1MGLL
SCHEMBL24598773 0.94 ENPP2 (0.62) ENPP2TTRKDM4EALDH1A1MGLL
SCHEMBL31047371 0.94 ENPP2 (0.62) ENPP2TTRKDM4EALDH1A1MGLL
SCHEMBL31047372 0.88 ENPP2 (0.57) ENPP2TTRKDM4EALDH1A1MGLL
SCHEMBL24598771 0.84 RELA (0.67) ENPP2TTRKDM4ENFE2L2
SCHEMBL856015 0.82 NPSR1 (0.59) ENPP2TTRKDM4EALDH1A1CA4
SCHEMBL12215721 0.82 ENPP2 (0.56) ENPP2TTRKDM4EALDH1A1MGLL
SCHEMBL2555210 0.82 ENPP2 (1.00) ENPP2TTRKDM4EALDH1A1MGLL
SCHEMBL1511647 0.82 NPSR1 (0.59) ENPP2TTRKDM4EALDH1A1CA4
SCHEMBL2555208 0.82 ENPP2 (1.00) ENPP2TTRKDM4EALDH1A1MGLL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-7133284-A None JP disclosed
JP-H07133284-A STILBENEDIBORONIC ACID COMPOUND RES DEV CORP OF JAPAN 1995-05-23 JP disclosed