SCHEMBL23620035

SCHEMBL23620035

COc1nccc2c(SN)cc(NC(=O)Cc3cc(F)c(F)cc3Cl)cc12

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.39
ANO1 Q5XXA6 8/20 0.38
EGFR P00533 2/20 0.36
P2RX7 Q99572 2/20 0.36
ALDH1A1 P00352 1/20 0.36
ERBB2 P04626 1/20 0.35
ERBB4 Q15303 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
RORA P35398 1/20 0.35
NR2E1 Q9Y466 1/20 0.35
CSF1R P07333 1/20 0.34
RET P07949 1/20 0.34
PDGFRB P09619 1/20 0.34
KIT P10721 1/20 0.34
PDGFRA P16234 1/20 0.34
DDR1 Q08345 1/20 0.34
RORC P51449 1/20 0.34

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
SCHEMBL24713270 0.90 RECQL (0.45) RECQLANO1P2RX7ALDH1A1SMN1; SMN2
SCHEMBL23620047 0.90 ANO1 (0.49) RECQLANO1P2RX7SMN1; SMN2CSF1R
SCHEMBL23619780 0.88 RECQL (0.53) RECQLANO1P2RX7ALDH1A1NR2E1
SCHEMBL23619949 0.87 ANO1 (0.47) ANO1RORANR2E1
SCHEMBL23620098 0.86 RECQL (0.43) RECQLANO1P2RX7SMN1; SMN2RORA
SCHEMBL23620027 0.85 SMN1; SMN2 (0.53) ALDH1A1SMN1; SMN2
SCHEMBL23620196 0.85 SMN1; SMN2 (0.40) RECQLANO1ALDH1A1SMN1; SMN2CSF1R
SCHEMBL23620202 0.85 SMN1; SMN2 (0.39) RECQLANO1SMN1; SMN2CSF1RRET
SCHEMBL23619837 0.84 P2RX4 (0.44) RECQLANO1
SCHEMBL30812925 0.84 P2RX4 (0.44) RECQLANO1

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