SCHEMBL24969075

SCHEMBL24969075

C=CC(=O)Nc1ccc(OCc2cccc(F)c2)c(C2CCCCC2)c1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EGFR P00533 9/20 0.53
ERBB2 P04626 4/20 0.53
ERBB4 Q15303 1/20 0.53
PTGDR2 Q9Y5Y4 3/20 0.47
MRGPRX4 Q96LA9 1/20 0.43
HTR6 P50406 1/20 0.42
PTGDR Q13258 1/20 0.41
LRRK2 Q5S007 1/20 0.41
JAK3 P52333 1/20 0.40
MAOA P21397 1/20 0.40
MAOB P27338 1/20 0.40

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
SCHEMBL30152362 0.95 EGFR (0.56) EGFRERBB2ERBB4PTGDR2MRGPRX4
SCHEMBL24969080 0.95 EGFR (0.56) EGFRERBB2ERBB4PTGDR2MRGPRX4
SCHEMBL24969094 0.82 EGFR (0.61) EGFRERBB2ERBB4LRRK2JAK3
SCHEMBL24968811 0.81 EGFR (0.59) EGFRERBB2ERBB4MRGPRX4LRRK2
SCHEMBL24968809 0.81 EGFR (0.75) EGFRERBB2ERBB4
SCHEMBL24969077 0.80 EGFR (0.58) EGFRERBB2ERBB4
SCHEMBL24969076 0.79 EGFR (0.57) EGFRERBB2ERBB4MRGPRX4LRRK2
SCHEMBL24968448 0.78 EGFR (0.56) EGFRERBB2ERBB4MRGPRX4
SCHEMBL30152371 0.78 EGFR (0.56) EGFRERBB2ERBB4MRGPRX4
SCHEMBL22914708 0.77 EGFR (0.52) EGFRERBB2ERBB4

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