SCHEMBL23619989

SCHEMBL23619989

N[S+]([O-])c1cc(NC(=O)Cc2ccccc2Cl)cc2ncccc12

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KCNJ5 P48544 5/20 0.46
KCNJ3 P48549 5/20 0.46
NR1I2 O75469 1/20 0.46
KCNJ6 P48051 1/20 0.45
ANO1 Q5XXA6 6/20 0.45
P2RX4 Q99571 3/20 0.44
NR2E1 Q9Y466 2/20 0.43
RORA P35398 1/20 0.43
CLK2 P49760 1/20 0.42
PRKX P51817 1/20 0.42
CAMK2D Q13557 1/20 0.42
PKN2 Q16513 1/20 0.42
CLK4 Q9HAZ1 1/20 0.42
STK17A Q9UEE5 1/20 0.42
MAPK8 P45983 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
SCHEMBL24713227 0.92 KCNJ5 (0.48) KCNJ5KCNJ3NR1I2KCNJ6ANO1
SCHEMBL23619948 0.82 KCNJ5 (0.49) KCNJ5KCNJ3NR1I2KCNJ6ANO1
SCHEMBL23619723 0.82 KCNJ5 (0.51) KCNJ5KCNJ3NR1I2KCNJ6ANO1
SCHEMBL30812897 0.82 KCNJ5 (0.51) KCNJ5KCNJ3NR1I2KCNJ6ANO1
SCHEMBL24713237 0.82 CSNK1D (0.44) KCNJ5KCNJ3NR1I2KCNJ6ANO1
SCHEMBL24713527 0.81 CLK2 (0.46) KCNJ5KCNJ3NR1I2KCNJ6ANO1
SCHEMBL23619747 0.80 P2RX4 (0.61) P2RX4
SCHEMBL30812854 0.80 P2RX4 (0.61) P2RX4
SCHEMBL24713273 0.80 KCNJ5 (0.42) KCNJ5KCNJ3NR1I2KCNJ6ANO1
SCHEMBL23619942 0.80 KCNJ5 (0.49) KCNJ5KCNJ3NR1I2KCNJ6ANO1

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