SCHEMBL24968520

SCHEMBL24968520

C=CC(=O)Nc1ccc(Oc2cccc(C(C)(C)C)c2)c(F)c1

nearest known ligand 0.55

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 2/20 0.55
KDR P35968 2/20 0.49
BRAF P15056 2/20 0.49
EGFR P00533 7/20 0.48
ITK Q08881 4/20 0.48
BLK P51451 2/20 0.46
BRD4 O60885 4/20 0.46
TGM2 P21980 1/20 0.45
BTK Q06187 1/20 0.44

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
SCHEMBL24968529 0.87 BRAF (0.49) KDRBRAFEGFRITKBRD4
SCHEMBL24969515 0.86 FFAR1 (0.59) FFAR1KDRBRAF
SCHEMBL24969112 0.85 FFAR1 (0.53) FFAR1KDRBRAFEGFRITK
SCHEMBL24968522 0.85 BRD4 (0.52) KDRBRAFEGFRITKBLK
SCHEMBL24968532 0.83 TGM2 (0.65) EGFRITKBLKBRD4TGM2
SCHEMBL24969114 0.79 TGM2 (0.57) FFAR1KDRBRAFEGFRBRD4
SCHEMBL24968527 0.78 TGM2 (0.60) KDRBRAFBLKBRD4TGM2
SCHEMBL22731792 0.78 TGM2 (0.50) KDRBRAFEGFRBLKTGM2
SCHEMBL13154807 0.78 TGM2 (0.59) KDREGFRTGM2
SCHEMBL30684820 0.78 TGM2 (0.59) KDREGFRTGM2

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
WO-2023009785-A1 TEAD INHIBITORS AND USES THEREOF CEDILLA THERAPEUTICS, INC. (US) 2023-02-02 WO disclosed