SCHEMBL29648372

SCHEMBL29648372

CNS(=O)(=O)c1ccc(NC2CCC(C(F)(F)F)CC2)c(-c2cn(C)cn2)c1

nearest known ligand 0.60

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TEAD1 P28347 3/20 0.60
YAP1 P46937 1/20 0.60
BRD4 O60885 8/20 0.40
SYK P43405 3/20 0.40
TNNI3K Q59H18 4/20 0.34
ITK Q08881 1/20 0.34
TLR2 O60603 1/20 0.33
TLR1 Q15399 1/20 0.33

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
SCHEMBL20779718 1.00 TEAD1 (0.60) TEAD1YAP1BRD4SYKTNNI3K
SCHEMBL22635634 1.00 TEAD1 (0.60) TEAD1YAP1BRD4SYKTNNI3K
SCHEMBL20779716 1.00 TEAD1 (0.60) TEAD1YAP1BRD4SYKTNNI3K
SCHEMBL20766526 0.87 YAP1 (0.57) TEAD1YAP1BRD4SYK
SCHEMBL24496071 0.86 TEAD1 (0.59) TEAD1YAP1BRD4TNNI3K
SCHEMBL24496073 0.86 TEAD1 (0.59) TEAD1YAP1BRD4TNNI3K
SCHEMBL24496258 0.86 TEAD1 (0.59) TEAD1YAP1BRD4TNNI3K
SCHEMBL26669265 0.86 TEAD1 (0.59) TEAD1YAP1BRD4TNNI3K
SCHEMBL24496015 0.84 BRD4 (0.48) TEAD1YAP1BRD4SYKITK
SCHEMBL24496014 0.84 BRD4 (0.48) TEAD1YAP1BRD4SYKITK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117561061-A Combination of 3- (imidazol-4-yl) -4- (amino) -benzenesulfonamide TEAD inhibitors with EGFR inhibitors and/or MEK inhibitors for the treatment of lung cancer 医肯纳肿瘤学公司 2024-02-13 CN disclosed
EP-4281073-A1 COMBINATION OF A 3-(IMIDAZOL-4-YL)-4-(AMINO)-BENZENESULFONAMIDE TEAD INHIBITOR WITH AN EGFR INHIBITOR AND/OR MEK INHIBITOR FOR USE IN THE TREATMENT OF LUNG CANCER Ikena Oncology, Inc. (US) 2023-11-29 EP disclosed
CN-111542315-B Benzosulfonyl compounds 维瓦斯治疗公司 2023-05-12 CN disclosed
EP-3691623-B1 BENZOSULFONYL COMPOUNDS VIVACE THERAPEUTICS INC (US) 2022-10-05 EP disclosed
WO-2022159986-A1 COMBINATION OF A 3-(IMIDAZOL-4-YL)-4-(AMINO)-BENZENESULFONAMIDE TEAD INHIBITOR WITH AN EGFR INHIBITOR AND/OR MEK INHIBITOR FOR USE IN THE TREATMENT OF LUNG CANCER Ikena Oncology, Inc. (US) 2022-07-28 WO disclosed
WO-2022120353-A1 TEAD INHIBITORS AND USES THEREOF Ikena Oncology, Inc. (US) 2022-06-09 WO disclosed
WO-2022120355-A1 TEAD DEGRADERS AND USES THEREOF Ikena Oncology, Inc. (US) 2022-06-09 WO disclosed