SCHEMBL30135282

SCHEMBL30135282

CNS(=O)(=O)c1ccc(Nc2ccc(C(F)(F)OC)cn2)c(-c2cn(C)cn2)c1

nearest known ligand 0.66

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ TEAD1 P28347 4/20 0.66
▸ YAP1 P46937 1/20 0.66
▸ BRAF P15056 8/20 0.42
▸ TNNI3K Q59H18 10/20 0.42
▸ MAPT P10636 1/20 0.41
▸ TLR2 O60603 1/20 0.35
▸ TLR1 Q15399 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
SCHEMBL24788980 1.00 TEAD1 (0.66) TEAD1YAP1BRAFTNNI3KMAPT
SCHEMBL22718190 0.91 TEAD1 (0.77) TEAD1YAP1BRAFTNNI3KMAPT
SCHEMBL29438880 0.91 TEAD1 (0.77) TEAD1YAP1BRAFTNNI3KMAPT
SCHEMBL24788978 0.89 TEAD1 (0.61) TEAD1YAP1BRAFTNNI3KMAPT
SCHEMBL30129838 0.89 TEAD1 (0.61) TEAD1YAP1BRAFTNNI3KMAPT
SCHEMBL24788977 0.88 TEAD1 (0.82) TEAD1YAP1BRAFTNNI3KTLR2
SCHEMBL29438838 0.88 TEAD1 (0.66) TEAD1YAP1BRAFTNNI3KMAPT
SCHEMBL22718188 0.88 TEAD1 (0.66) TEAD1YAP1BRAFTNNI3KMAPT
SCHEMBL22718358 0.85 TEAD1 (0.63) TEAD1YAP1BRAFTNNI3KMAPT
SCHEMBL29438916 0.85 TEAD1 (0.63) 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-2022258040-A1 HETEROCYCLIC COMPOUND FOR TEAD INHIBITOR 武汉人福创新药物研发中心有限公司 2022-12-15 — — WO disclosed
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