SCHEMBL23620072

SCHEMBL23620072

COc1nccc2c(SN)cc(NC(=O)Cc3ccccc3C#N)cc12

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NR2E1 Q9Y466 1/20 0.42
MEN1 O00255 1/20 0.39
TSHR P16473 1/20 0.39
KMT2A Q03164 1/20 0.39
MAPK8 P45983 4/20 0.39
MAPK9 P45984 4/20 0.39
MAPK10 P53779 1/20 0.39
GPR6 P46095 1/20 0.37
P2RX7 Q99572 1/20 0.36
WNT3A P56704 2/20 0.35
NOTUM Q6P988 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
BCHE P06276 1/20 0.34
ACHE P22303 1/20 0.34
MALT1 Q9UDY8 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
SCHEMBL23619949 0.86 ANO1 (0.47) NR2E1MAPK8MAPK9
SCHEMBL23619952 0.85 P2RX4 (0.42) NR2E1MEN1TSHRKMT2AMAPK8
SCHEMBL30812907 0.85 P2RX4 (0.42) NR2E1MEN1TSHRKMT2AMAPK8
SCHEMBL23620213 0.83 ANO1 (0.40) MEN1TSHRKMT2AMAPK8MAPK9
SCHEMBL23620207 0.82 MEN1 (0.44) MEN1TSHRKMT2ASMN1; SMN2
SCHEMBL24713235 0.80 ANO1 (0.38) MEN1TSHRKMT2ASMN1; SMN2
SCHEMBL23619780 0.80 RECQL (0.53) NR2E1MEN1KMT2AP2RX7
SCHEMBL23620024 0.80 SMN1; SMN2 (0.47) MEN1TSHRKMT2ASMN1; SMN2
SCHEMBL23620035 0.79 RECQL (0.39) NR2E1P2RX7SMN1; SMN2
SCHEMBL23620098 0.78 RECQL (0.43) NR2E1MEN1TSHRKMT2AP2RX7

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