SCHEMBL8796473

SCHEMBL8796473

O=c1[nH]c2c(c(O)c1-c1ccccc1)Cc1ccccc1-2

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.47
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA4 P22748 1/20 0.45
CA6 P23280 1/20 0.45
KDR P35968 1/20 0.44
SERPINE1 P05121 1/20 0.43
PARP1 P09874 3/20 0.41
KDM4E B2RXH2 1/20 0.41

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
SCHEMBL28442240 0.73 PNMT (0.42) MAPTCA1CA2CA4CA6
SCHEMBL2763222 0.72 PARP1 (0.70) CA1CA2CA4CA6PARP1
SCHEMBL18337985 0.72 KDR (0.42) MAPTCA1CA2CA4CA6
SCHEMBL4954076 0.70 CA1 (0.51) CA1CA2CA4CA6KDR
SCHEMBL27440875 0.70 CA1 (0.54) CA1CA2CA4CA6KDR
SCHEMBL2359259 0.70 KDR (0.41) MAPTCA1CA2CA4CA6
SCHEMBL18337982 0.70 MAP3K9 (0.41) MAPTCA1CA2CA4CA6
SCHEMBL28444674 0.70 KDR (0.41) MAPTCA1CA2CA4CA6
SCHEMBL22159915 0.70 PNMT (0.42) MAPTKDRKDM4E
SCHEMBL2359255 0.69 MAP3K9 (0.41) MAPTCA1CA2CA4CA6

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
EP-0772612-A1 4-HYDROXY-3-PHENYL-INDENO(1,2-B)PYRIDINE-2(1H)-ONE DERIVATIVES AS NMDA ANTAGONISTS Aventis Pharma S.A. (FR) 1997-05-14 EP disclosed
WO-1996002536-A1 4-HYDROXY-3-PHENYL-INDENO(1,2-B)PYRIDINE-2(1H)-ONE DERIVATIVES AS NMDA ANTAGONISTS RHONE-POULENC RORER S.A. (FR) 1996-02-01 WO disclosed