SCHEMBL7517440

SCHEMBL7517440

COc1ccc2c(c1)c1c([O])cccc1n2Cc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.56
MAPK1 P28482 1/20 0.56
KMT2A Q03164 1/20 0.56
PLA2G2A P14555 12/20 0.55
PLA2G1B P04054 1/20 0.55
P2RX4 Q99571 1/20 0.53
HTR6 P50406 1/20 0.52
NTRK1 P04629 1/20 0.50

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
SCHEMBL6920467 0.85 PLA2G2A (0.55) TSHRMAPK1KMT2APLA2G2APLA2G1B
SCHEMBL6983559 0.82 PLA2G2A (0.59) PLA2G2APLA2G1B
SCHEMBL14280388 0.81 P2RX4 (0.77) TSHRMAPK1KMT2APLA2G2APLA2G1B
SCHEMBL6924402 0.79 HTR6 (0.49) TSHRMAPK1KMT2APLA2G2APLA2G1B
SCHEMBL6924426 0.78 TSHR (0.47) TSHRMAPK1KMT2APLA2G2APLA2G1B
SCHEMBL6925937 0.75 PLA2G2A (0.53) PLA2G2APLA2G1BP2RX4NTRK1
SCHEMBL12301941 0.74 KMT2A (0.68) TSHRMAPK1KMT2APLA2G2APLA2G1B
SCHEMBL29093447 0.74 KMT2A (0.62) KMT2AP2RX4
SCHEMBL30616062 0.74 KMT2A (0.62) KMT2AP2RX4
SCHEMBL8235994 0.73 PLA2G2A (0.67) TSHRMAPK1KMT2APLA2G2APLA2G1B

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-1210329-A2 AMINOALKOXY CARBAZOLES AND THEIR USE AS 5-HT LIGANDS PHARMACIA & UPJOHN COMPANY (US) 2002-06-05 EP disclosed
WO-2001017963-A2 AMINOALKOXY CARBAZOLES AND THEIR USE AS 5-HT LIGANDS PHARMACIA & UPJOHN COMPANY (US) 2001-03-15 WO disclosed