SCHEMBL29438880

SCHEMBL29438880

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

nearest known ligand 0.77

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ TEAD1 P28347 4/20 0.77
▸ YAP1 P46937 1/20 0.77
▸ TNNI3K Q59H18 6/20 0.51
▸ MAPT P10636 1/20 0.48
▸ BRAF P15056 5/20 0.44
▸ TLR2 O60603 1/20 0.41
▸ TLR1 Q15399 1/20 0.41
▸ TSHR P16473 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ MAPK10 P53779 1/20 0.37
▸ CCNK O75909 1/20 0.37
▸ CCNA2 P20248 1/20 0.37
▸ CDK2 P24941 1/20 0.37
▸ CDK12 Q9NYV4 1/20 0.37

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
SCHEMBL22718190 1.00 TEAD1 (0.77) TEAD1YAP1TNNI3KMAPTBRAF
SCHEMBL29438838 0.91 TEAD1 (0.66) TEAD1YAP1TNNI3KMAPTBRAF
SCHEMBL22718188 0.91 TEAD1 (0.66) TEAD1YAP1TNNI3KMAPTBRAF
SCHEMBL24788980 0.91 TEAD1 (0.66) TEAD1YAP1TNNI3KMAPTBRAF
SCHEMBL30135282 0.91 TEAD1 (0.66) TEAD1YAP1TNNI3KMAPTBRAF
SCHEMBL22718325 0.90 TEAD1 (0.62) TEAD1YAP1TNNI3KMAPTBRAF
SCHEMBL29438868 0.90 TEAD1 (0.62) TEAD1YAP1TNNI3KMAPTBRAF
SCHEMBL24501728 0.89 TEAD1 (0.61) TEAD1YAP1TNNI3KMAPTTLR2
SCHEMBL24501068 0.89 TEAD1 (0.61) TEAD1YAP1TNNI3KMAPTBRAF
SCHEMBL22718301 0.88 TEAD1 (0.76) TEAD1YAP1TNNI3KMAPTBRAF

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
EP-3976194-A2 TEAD INHIBITORS AND USES THEREOF Ikena Oncology, Inc. (US) 2022-04-06 — — EP disclosed
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