SCHEMBL29648281

SCHEMBL29648281

CNS(=O)(=O)c1ccc(NCc2ccc(C(F)(F)F)cc2)c(-c2cn(-c3ccncc3)cn2)c1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ TEAD1 P28347 1/20 0.55
▸ YAP1 P46937 1/20 0.55
▸ TLR2 O60603 7/20 0.44
▸ TLR1 Q15399 7/20 0.44
▸ FLT1 P17948 5/20 0.42
▸ KDR P35968 5/20 0.42
▸ KDM4E B2RXH2 1/20 0.37
▸ ASPH Q12797 1/20 0.37
▸ RIOX2 Q8IUF8 1/20 0.37
▸ KDM8 Q8N371 1/20 0.37
▸ PTGS2 P35354 1/20 0.37
▸ NAMPT P43490 1/20 0.36
▸ CCR9 P51686 1/20 0.36
▸ EPHB4 P54760 1/20 0.36
▸ SCN3A Q9NY46 1/20 0.36
▸ TNNI3K Q59H18 1/20 0.36

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
SCHEMBL24496022 1.00 TEAD1 (0.55) TEAD1YAP1TLR2TLR1FLT1
SCHEMBL22718245 0.86 TEAD1 (0.74) TEAD1YAP1TLR2TLR1FLT1
SCHEMBL29648434 0.84 TEAD1 (0.65) TEAD1YAP1TLR2TLR1FLT1
SCHEMBL24496331 0.82 TEAD1 (0.55) TEAD1YAP1TLR2TLR1FLT1
SCHEMBL24496081 0.81 TEAD1 (0.56) TEAD1YAP1TLR2TLR1KDM4E
SCHEMBL24496380 0.80 TEAD1 (0.54) TEAD1YAP1TLR2TLR1FLT1
SCHEMBL29648374 0.80 TEAD1 (0.54) TEAD1YAP1TLR2TLR1FLT1
SCHEMBL24496020 0.79 TEAD1 (0.52) TEAD1YAP1KDM4EASPHRIOX2
SCHEMBL24496080 0.78 TEAD1 (0.53) TEAD1YAP1TLR2TLR1KDM4E
SCHEMBL24496265 0.78 TEAD1 (0.58) TEAD1YAP1TLR2TLR1FLT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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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