SCHEMBL29648405

SCHEMBL29648405

CNS(=O)(=O)c1ccc(Nc2ccc(C(F)(F)F)cn2)c(-c2ccc(C#N)cn2)c1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ TNNI3K Q59H18 5/20 0.51
▸ TEAD1 P28347 1/20 0.50
▸ YAP1 P46937 1/20 0.50
▸ MAPT P10636 1/20 0.46
▸ BRAF P15056 4/20 0.45
▸ CCR6 P51684 3/20 0.43
▸ TRPV1 Q8NER1 1/20 0.42
▸ SCN9A Q15858 2/20 0.41
▸ DYRK3 O43781 1/20 0.39
▸ GSK3A P49840 1/20 0.39
▸ GSK3B P49841 1/20 0.39
▸ DYRK1A Q13627 1/20 0.39
▸ CLK4 Q9HAZ1 1/20 0.39
▸ STK17A Q9UEE5 1/20 0.39

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
SCHEMBL24496005 1.00 TNNI3K (0.51) TNNI3KTEAD1YAP1MAPTBRAF
SCHEMBL24496013 0.88 TEAD1 (0.49) TNNI3KTEAD1YAP1MAPTBRAF
SCHEMBL24496260 0.84 TEAD1 (0.51) TNNI3KTEAD1YAP1MAPTBRAF
SCHEMBL29648401 0.84 TEAD1 (0.51) TNNI3KTEAD1YAP1MAPTBRAF
SCHEMBL22718227 0.83 TNNI3K (0.54) TNNI3KTEAD1YAP1MAPTBRAF
SCHEMBL29438827 0.83 TNNI3K (0.54) TNNI3KTEAD1YAP1MAPTBRAF
SCHEMBL24496353 0.81 TEAD1 (0.57) TNNI3KTEAD1YAP1MAPTBRAF
SCHEMBL22718299 0.80 TEAD1 (0.57) TNNI3KTEAD1YAP1BRAFCCR6
SCHEMBL22718190 0.80 TEAD1 (0.77) TNNI3KTEAD1YAP1MAPTBRAF
SCHEMBL29438880 0.80 TEAD1 (0.77) TNNI3KTEAD1YAP1MAPTBRAF

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 5 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
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
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