SCHEMBL24879934

SCHEMBL24879934

CNS(=O)(=O)c1ccc(Nc2ccc(C(F)(F)OC3CC3)cn2)c(-c2cn3c(n2)CCC3)c1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ TEAD1 P28347 2/20 0.42
▸ YAP1 P46937 1/20 0.42
▸ BRAF P15056 5/20 0.36
▸ TNNI3K Q59H18 8/20 0.36
▸ MAPT P10636 1/20 0.35
▸ CDK2 P24941 4/20 0.32
▸ CCNE1 P24864 3/20 0.32
▸ WDR5 P61964 1/20 0.32
▸ CCNK O75909 2/20 0.32
▸ CDK12 Q9NYV4 2/20 0.32
▸ CCNA2 P20248 1/20 0.32
▸ CCR6 P51684 1/20 0.32
▸ CCNT1 O60563 1/20 0.31
▸ CDK9 P50750 1/20 0.31

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
SCHEMBL24879914 0.91 TEAD1 (0.44) TEAD1YAP1BRAFTNNI3KMAPT
SCHEMBL24879863 0.89 TEAD1 (0.51) TEAD1YAP1BRAFTNNI3KMAPT
SCHEMBL30114160 0.87 TEAD1 (0.50) TEAD1YAP1BRAFTNNI3KMAPT
SCHEMBL24879883 0.87 TEAD1 (0.50) TEAD1YAP1BRAFTNNI3KMAPT
SCHEMBL24879937 0.85 KCNH2 (0.32) WDR5
SCHEMBL30129838 0.84 TEAD1 (0.61) TEAD1YAP1BRAFTNNI3KMAPT
SCHEMBL24788978 0.84 TEAD1 (0.61) TEAD1YAP1BRAFTNNI3KMAPT
SCHEMBL24880010 0.78 TEAD1 (0.49) TEAD1YAP1BRAFTNNI3KMAPT
SCHEMBL30114385 0.78 TEAD1 (0.49) TEAD1YAP1BRAFTNNI3KMAPT
SCHEMBL24880012 0.78 TEAD1 (0.51) TEAD1YAP1BRAFTNNI3KMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023280254-A1 TEAD INHIBITOR 武汉人福创新药物研发中心有限公司 2023-01-12 — — WO disclosed
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