SCHEMBL23619976

SCHEMBL23619976

COc1nccc2c(SN)cc(NC(=O)Cc3c(O)cccc3Cl)cc12

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ANO1 Q5XXA6 3/20 0.49
SMN1; SMN2 Q16637 3/20 0.45
MAPT P10636 2/20 0.40
RECQL P46063 1/20 0.39
THRB P10828 1/20 0.38
P2RX4 Q99571 2/20 0.36
TSHR P16473 1/20 0.36
KMT2A Q03164 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
LMNA P02545 1/20 0.36
PTPN1 P18031 1/20 0.35
NR2E1 Q9Y466 1/20 0.35
RORC P51449 1/20 0.35

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
SCHEMBL23620199 0.91 SMN1; SMN2 (0.45) ANO1SMN1; SMN2MAPTRECQLTHRB
SCHEMBL23620027 0.90 SMN1; SMN2 (0.53) SMN1; SMN2MAPTTSHRKMT2ANPSR1
SCHEMBL23619949 0.86 ANO1 (0.47) ANO1P2RX4NR2E1
SCHEMBL23620202 0.86 SMN1; SMN2 (0.39) ANO1SMN1; SMN2MAPTRECQLP2RX4
SCHEMBL30812901 0.85 ANO1 (0.52) ANO1SMN1; SMN2P2RX4LMNA
SCHEMBL23619951 0.85 ANO1 (0.52) ANO1SMN1; SMN2P2RX4LMNA
SCHEMBL23620196 0.85 SMN1; SMN2 (0.40) ANO1SMN1; SMN2MAPTRECQLP2RX4
SCHEMBL23619780 0.81 RECQL (0.53) ANO1MAPTRECQLTHRBKMT2A
SCHEMBL23620035 0.81 RECQL (0.39) ANO1SMN1; SMN2RECQLNR2E1RORC
SCHEMBL23620213 0.81 ANO1 (0.40) ANO1SMN1; SMN2MAPTTSHRKMT2A

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