SCHEMBL7542492

SCHEMBL7542492

CC(C)CC(C(=O)NC(CCNCC(NC(=O)CC(C)(C)C)C(=O)O)C(=O)O)c1ccc(NC(=O)Nc2ccc(Cl)cc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 1/20 0.39
▸ FOLH1 Q04609 1/20 0.38
▸ FFAR2 O15552 1/20 0.37
▸ FPR2 P25090 3/20 0.37
▸ GRN P28799 1/20 0.37
▸ SORT1 Q99523 1/20 0.37
▸ ALDH1A1 P00352 2/20 0.36
▸ LMNA P02545 2/20 0.36
▸ SLC6A3 Q01959 1/20 0.36
▸ UTS2R Q9UKP6 2/20 0.35
▸ MAPK14 Q16539 1/20 0.35
▸ CASR P41180 1/20 0.35
▸ IDH1 O75874 1/20 0.35

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
SCHEMBL7545836 1.00 MAPK1 (0.39) MAPK1FOLH1FFAR2FPR2GRN
SCHEMBL7541941 0.93 GAA (0.41) MAPK1FPR2ALDH1A1LMNA
SCHEMBL7541814 0.92 MAPK1 (0.38) MAPK1FPR2ALDH1A1LMNASLC6A3
SCHEMBL7541860 0.92 FOLH1 (0.39) MAPK1FOLH1FPR2ALDH1A1LMNA
SCHEMBL7541062 0.92 FOLH1 (0.39) MAPK1FOLH1FPR2ALDH1A1LMNA
SCHEMBL7539530 0.90 FOLH1 (0.45) MAPK1FOLH1FFAR2FPR2GRN
SCHEMBL7541671 0.90 ANPEP (0.46) FPR2CASR
SCHEMBL7568018 0.89 CTSK (0.35) MAPK1FOLH1FFAR2GRNSORT1
SCHEMBL7566389 0.89 CTSK (0.35) MAPK1FOLH1FFAR2GRNSORT1
SCHEMBL7538130 0.89 MEN1 (0.41) MAPK1FPR2ALDH1A1LMNA

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
EP-1209147-A1 CARBOXYLIC ACID DERIVATIVES AND ADHESION MOLECULE INHIBITORS CONTAINING THE SAME AS THE ACTIVE INGREDIENT TORAY INDUSTRIES, INC. (JP) 2002-05-29 — — EP disclosed
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