SCHEMBL6821058

SCHEMBL6821058

COc1ccc2c(c1)c(O)c(-c1ccccc1)n2Cc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 16/20 0.57
GRIK2 Q13002 1/20 0.56
PLA2G1B P04054 1/20 0.56
KMT2A Q03164 2/20 0.54
TSHR P16473 1/20 0.54
MAPK1 P28482 1/20 0.54
MAPT P10636 1/20 0.52
NTRK1 P04629 1/20 0.51

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
SCHEMBL6820689 0.84 PLA2G2A (0.68) PLA2G2APLA2G1BKMT2ATSHRMAPK1
SCHEMBL6821169 0.83 KMT2A (0.52) PLA2G2AKMT2ATSHRMAPK1MAPT
SCHEMBL6918963 0.81 KDR (0.50) KMT2ATSHRMAPT
SCHEMBL6920117 0.80 CA12 (0.48) PLA2G2AKMT2AMAPT
SCHEMBL6821059 0.80 MAPT (0.48) KMT2AMAPTNTRK1
SCHEMBL6820233 0.79 CYP19A1 (0.59) KMT2AMAPK1MAPTNTRK1
SCHEMBL9017573 0.79 PLA2G2A (0.74) PLA2G2APLA2G1BKMT2ATSHRMAPK1
SCHEMBL3855197 0.78 GRIK2 (0.64) PLA2G2AGRIK2PLA2G1BKMT2ATSHR
SCHEMBL6922144 0.77 ESR1 (0.51) PLA2G2AGRIK2PLA2G1BKMT2ATSHR
SCHEMBL6920467 0.76 PLA2G2A (0.55) PLA2G2APLA2G1BKMT2ATSHRMAPK1

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
WO-2004048331-A1 N-ARYLALKYL-3-AMINOALKOXYINDOLES AND THEIR USE AS 5-HT LIGANDS SUVEN LIFE SCIENCES LIMITED (IN) 2004-06-10 WO disclosed