SCHEMBL23620001

SCHEMBL23620001

NSc1cc(NC(=O)Cc2ccccc2Cl)cc2c(C3CC3)nccc12

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ANO1 Q5XXA6 10/20 0.47
KCNJ5 P48544 3/20 0.43
KCNJ3 P48549 3/20 0.43
RORA P35398 1/20 0.42
NR2E1 Q9Y466 1/20 0.42
P2RX4 Q99571 4/20 0.41
ROCK2 O75116 1/20 0.41
P2RX7 Q99572 1/20 0.40
KCNJ6 P48051 1/20 0.40

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
SCHEMBL23620000 0.85 ANO1 (0.48) ANO1KCNJ5KCNJ3RORANR2E1
SCHEMBL23620019 0.85 ANO1 (0.48) ANO1KCNJ5KCNJ3RORANR2E1
SCHEMBL23619947 0.84 P2RX4 (0.47) ANO1KCNJ5KCNJ3RORANR2E1
SCHEMBL23620189 0.84 NR2E1 (0.49) ANO1KCNJ5KCNJ3RORANR2E1
SCHEMBL30812841 0.84 P2RX4 (0.55) ANO1P2RX4
SCHEMBL23619827 0.84 P2RX4 (0.55) ANO1P2RX4
SCHEMBL23620005 0.84 P2RX4 (0.49) ANO1KCNJ5KCNJ3RORANR2E1
SCHEMBL23620013 0.83 P2RX4 (0.51) ANO1KCNJ5KCNJ3RORANR2E1
SCHEMBL23619746 0.83 ANO1 (0.48) ANO1KCNJ5KCNJ3RORANR2E1
SCHEMBL23619971 0.83 NR2E1 (0.46) ANO1KCNJ5KCNJ3RORANR2E1

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-4079724-A1 FUSED RING COMPOUND AND APPLICATION THEREOF Wuhan LL Science and Technology Development Co., Ltd. (CN) 2022-10-26 EP disclosed
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