SCHEMBL8943751

SCHEMBL8943751

COc1ccc(N(c2ccc(OC)cc2)c2ccccc2-c2cc(Oc3ccc(N(c4ccc(OC)cc4)c4ccc(OC)cc4)c(-c4ccccc4N(c4ccc(OC)cc4)c4ccc(OC)cc4)c3)ccc2N(c2ccc(OC)cc2)c2ccc(OC)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LTA4H P09960 1/20 0.43
▸ ABL1 P00519 1/20 0.40
▸ ABCB1 P08183 1/20 0.40
▸ BCR P11274 1/20 0.40
▸ PGR P06401 3/20 0.38
▸ RPS6KA2 Q15349 1/20 0.38
▸ CES1 P23141 2/20 0.38
▸ PTGES O14684 1/20 0.36
▸ HDAC4 P56524 2/20 0.36
▸ HDAC2 Q92769 2/20 0.36
▸ HDAC8 Q9BY41 2/20 0.36
▸ NPC1 O15118 2/20 0.36
▸ SMN1; SMN2 Q16637 3/20 0.36
▸ KDM4E B2RXH2 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ CA4 P22748 1/20 0.35
▸ KEAP1 Q14145 2/20 0.35
▸ NFE2L2 Q16236 2/20 0.35
▸ TP53 P04637 1/20 0.35

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
SCHEMBL8943844 0.88 HTT (0.35) CES1NPC1SMN1; SMN2ALDH1A1HTT
SCHEMBL8944213 0.87 MAOB (0.38) LTA4HKDM4EALDH1A1MAPTMAOA
SCHEMBL8944089 0.84 HTR2C (0.39) LTA4HABL1ABCB1BCRRPS6KA2
SCHEMBL1005483 0.82 ABL1 (0.51) LTA4HABL1ABCB1BCRRPS6KA2
SCHEMBL30501493 0.79 ABL1 (0.47) LTA4HABL1ABCB1BCRRPS6KA2
SCHEMBL16633166 0.76 ABL1 (0.47) LTA4HABL1ABCB1BCRRPS6KA2
SCHEMBL15662167 0.74 BACE1 (0.49) ABL1ABCB1BCRHDAC4HDAC2
SCHEMBL8943802 0.73 PTGES (0.51) LTA4HPTGESNPC1SMN1; SMN2ALDH1A1
SCHEMBL8943612 0.72 LTA4H (0.68) LTA4HPGRKDM4EALDH1A1HTT
SCHEMBL8943843 0.72 LTA4H (0.75) LTA4HPGRSMN1; SMN2KDM4EALDH1A1

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-5480765-A PRESSURE AND HEAT SENSITIVE PAPER, IMPROVED PHOTOSTABILITY BY ADDITION OF TRIARYLAMINE COMPOUND FUJI PHOTO FILM CO., LTD. (JP) 1996-01-02 — — US disclosed
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