SCHEMBL29438830

SCHEMBL29438830

CNS(=O)(=O)c1ccc(NCc2ccc(C(F)(F)F)cc2F)c(-c2cn(C)cn2)c1

nearest known ligand 0.66

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ TEAD1 P28347 3/20 0.66
▸ YAP1 P46937 1/20 0.66
▸ TLR2 O60603 4/20 0.41
▸ TLR1 Q15399 4/20 0.41
▸ KDM4E B2RXH2 1/20 0.39
▸ TSHR P16473 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ CASP6 P55212 1/20 0.37
▸ JAK3 P52333 1/20 0.36
▸ TRPV1 Q8NER1 1/20 0.36
▸ MOGAT2 Q3SYC2 1/20 0.36
▸ MAPT P10636 1/20 0.35
▸ ALOX5AP P20292 1/20 0.35
▸ FEN1 P39748 1/20 0.35
▸ TNNI3K Q59H18 3/20 0.34
▸ KIF11 P52732 1/20 0.34
▸ VNN1 O95497 1/20 0.34
▸ BRAF P15056 1/20 0.34

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
SCHEMBL22718065 1.00 TEAD1 (0.66) TEAD1YAP1TLR2TLR1KDM4E
SCHEMBL24496290 0.87 TEAD1 (0.50) TEAD1YAP1TLR2TLR1KDM4E
SCHEMBL22718245 0.87 TEAD1 (0.74) TEAD1YAP1TLR2TLR1KDM4E
SCHEMBL22718330 0.84 TEAD1 (0.67) TEAD1YAP1TLR2TLR1TSHR
SCHEMBL22718064 0.84 TEAD1 (0.65) TEAD1YAP1TLR2TLR1TRPV1
SCHEMBL22718356 0.83 TEAD1 (0.60) TEAD1YAP1KDM4ETSHRCASP6
SCHEMBL29648434 0.81 TEAD1 (0.65) TEAD1YAP1TLR2TLR1KDM4E
SCHEMBL29438825 0.80 TEAD1 (0.61) TEAD1YAP1TLR2TLR1MOGAT2
SCHEMBL22718414 0.80 TEAD1 (0.61) TEAD1YAP1TLR2TLR1MOGAT2
SCHEMBL20779435 0.80 TEAD1 (1.00) TEAD1YAP1TLR2TLR1TSHR

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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