SCHEMBL29504945

SCHEMBL29504945

C=Cc1cc(S(=O)(=O)NC)ccc1Nc1ccc(C(F)(F)F)cc1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ TEAD1 P28347 2/20 0.56
▸ YAP1 P46937 1/20 0.56
▸ TNNI3K Q59H18 5/20 0.50
▸ ALDH3A1 P30838 4/20 0.49
▸ MAPK1 P28482 2/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ ALOX15 P16050 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ MAPT P10636 2/20 0.41
▸ EPAS1 Q99814 1/20 0.40
▸ ALDH1A1 P00352 2/20 0.40
▸ AKR1C3 P42330 1/20 0.39
▸ AKR1C2 P52895 1/20 0.39
▸ FBP1 P09467 1/20 0.38
▸ KIF11 P52732 1/20 0.38

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
SCHEMBL22719765 1.00 TEAD1 (0.56) TEAD1YAP1TNNI3KALDH3A1MAPK1
SCHEMBL22719577 0.87 MAPT (0.57) TEAD1YAP1TNNI3KMEN1KMT2A
SCHEMBL29648442 0.83 TNNI3K (0.55) TEAD1YAP1TNNI3KMEN1KMT2A
SCHEMBL24497379 0.83 TNNI3K (0.55) TEAD1YAP1TNNI3KMEN1KMT2A
SCHEMBL20779892 0.82 TEAD1 (0.62) TEAD1YAP1TNNI3KALDH3A1MAPK1
SCHEMBL24497321 0.80 TNNI3K (0.50) TEAD1YAP1TNNI3KMAPK1MEN1
SCHEMBL22635666 0.78 ALDH1A1 (0.58) TEAD1YAP1TNNI3KMAPK1MEN1
SCHEMBL20779642 0.78 TEAD1 (0.56) TEAD1YAP1TNNI3KALDH3A1MAPK1
SCHEMBL30410558 0.78 TEAD1 (0.56) TEAD1YAP1TNNI3KALDH3A1MAPK1
SCHEMBL20766837 0.76 TEAD1 (0.54) TEAD1YAP1TNNI3KALDH3A1MAPK1

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-3976192-A1 TEAD INHIBITORS AND USES THEREOF Ikena Oncology, Inc. (US) 2022-04-06 — — EP disclosed
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