SCHEMBL24968522

SCHEMBL24968522

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

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 9/20 0.52
TGM2 P21980 2/20 0.50
BLK P51451 2/20 0.49
EGFR P00533 3/20 0.48
ITK Q08881 1/20 0.48
ERBB2 P04626 1/20 0.48
BRAF P15056 1/20 0.48
KDR P35968 1/20 0.48
PNLIP P16233 1/20 0.47
BTK Q06187 1/20 0.46

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
SCHEMBL24968532 0.88 TGM2 (0.65) BRD4TGM2BLKEGFRITK
SCHEMBL24969112 0.88 FFAR1 (0.53) BRD4TGM2BLKEGFRITK
SCHEMBL24968527 0.86 TGM2 (0.60) BRD4TGM2BLKBRAFKDR
SCHEMBL24968520 0.85 FFAR1 (0.55) BRD4TGM2BLKEGFRITK
SCHEMBL21392902 0.84 TGM2 (0.71) TGM2BLKEGFRERBB2BTK
SCHEMBL24969114 0.81 TGM2 (0.57) BRD4TGM2EGFRBRAFKDR
SCHEMBL24969094 0.80 EGFR (0.61) TGM2EGFRITKERBB2
SCHEMBL24968831 0.80 TGM2 (0.46) TGM2EGFRITKERBB2BTK
SCHEMBL30152207 0.80 TGM2 (0.46) TGM2EGFRITKERBB2BTK
SCHEMBL24968529 0.78 BRAF (0.49) BRD4TGM2EGFRITKBRAF

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