SCHEMBL29438933

SCHEMBL29438933

COc1ccc(CN(C)S(=O)(=O)c2ccc(Nc3ccc(C(C)(C)C)cn3)c(-c3cn(C)cn3)c2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TEAD1 P28347 1/20 0.42
▸ YAP1 P46937 1/20 0.42
▸ ACLY P53396 1/20 0.37
▸ PTGER2 P43116 2/20 0.37
▸ MAPK8 P45983 1/20 0.37
▸ MAPK10 P53779 1/20 0.37
▸ MEN1 O00255 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ CCR9 P51686 2/20 0.35
▸ KAT8 Q9H7Z6 2/20 0.35
▸ NR1I2 O75469 1/20 0.34
▸ TTK P33981 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ MAOA P21397 1/20 0.33
▸ MAOB P27338 1/20 0.33
▸ CASP3 P42574 1/20 0.33
▸ CCR6 P51684 1/20 0.33
▸ BMP1 P13497 1/20 0.33
▸ ADRB2 P07550 1/20 0.33

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
SCHEMBL29438934 1.00 TEAD1 (0.42) TEAD1YAP1ACLYPTGER2MAPK8
SCHEMBL22718097 1.00 TEAD1 (0.42) TEAD1YAP1ACLYPTGER2MAPK8
SCHEMBL29438915 0.93 TEAD1 (0.49) TEAD1YAP1MAPK8MAPK10MEN1
SCHEMBL22718251 0.93 TEAD1 (0.49) TEAD1YAP1MAPK8MAPK10MEN1
SCHEMBL29438917 0.93 TEAD1 (0.49) TEAD1YAP1MAPK8MAPK10MEN1
SCHEMBL24496182 0.90 TEAD1 (0.39) TEAD1YAP1ACLYMAPK8MAPK10
SCHEMBL29648333 0.90 TEAD1 (0.39) TEAD1YAP1ACLYMAPK8MAPK10
SCHEMBL22718047 0.89 TEAD1 (0.42) TEAD1YAP1ACLYMAPK8MAPK10
SCHEMBL29438890 0.89 TEAD1 (0.42) TEAD1YAP1ACLYMAPK8MAPK10
SCHEMBL24495997 0.89 TSHR (0.38) TEAD1YAP1ACLYMAPK8MAPK10

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119954725-A TEAD inhibitors and uses thereof 医肯纳肿瘤学公司 2025-05-09 — — CN disclosed
CN-114466839-B TEAD inhibitors and uses thereof 医肯纳肿瘤学公司 2025-01-07 — — CN disclosed
EP-3976194-A2 TEAD INHIBITORS AND USES THEREOF Ikena Oncology, Inc. (US) 2022-04-06 — — EP disclosed
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