SCHEMBL23619892

SCHEMBL23619892

NSc1cc(NC(=O)Cc2ccccc2Cl)cc2c(OC3CCC3)nccc12

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
P2RX4 Q99571 8/20 0.49
ANO1 Q5XXA6 8/20 0.43
KCNJ5 P48544 2/20 0.40
KCNJ3 P48549 2/20 0.40
RORA P35398 1/20 0.40
NR2E1 Q9Y466 1/20 0.40
CLK2 P49760 1/20 0.39
PRKX P51817 1/20 0.39
CAMK2D Q13557 1/20 0.39
PKN2 Q16513 1/20 0.39
CLK4 Q9HAZ1 1/20 0.39
STK17A Q9UEE5 1/20 0.39

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
SCHEMBL23620013 0.98 P2RX4 (0.51) P2RX4ANO1KCNJ5KCNJ3RORA
SCHEMBL23619947 0.96 P2RX4 (0.47) P2RX4ANO1KCNJ5KCNJ3RORA
SCHEMBL23619852 0.91 ANO1 (0.43) P2RX4ANO1KCNJ5KCNJ3RORA
SCHEMBL23619991 0.88 ANO1 (0.42) P2RX4ANO1KCNJ5KCNJ3RORA
SCHEMBL23620005 0.87 P2RX4 (0.49) P2RX4ANO1KCNJ5KCNJ3RORA
SCHEMBL23619891 0.86 P2RX4 (0.63) P2RX4
SCHEMBL30812821 0.86 P2RX4 (0.63) P2RX4
SCHEMBL23619949 0.86 ANO1 (0.47) P2RX4ANO1KCNJ5KCNJ3RORA
SCHEMBL23620009 0.85 ANO1 (0.45) P2RX4ANO1KCNJ5KCNJ3RORA
SCHEMBL24714040 0.85 RORA (0.44) P2RX4ANO1KCNJ5KCNJ3RORA

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-2021136238-A1 FUSED RING COMPOUND AND APPLICATION THEREOF 武汉朗来科技发展有限公司 2021-07-08 WO disclosed