SCHEMBL7538838

SCHEMBL7538838

CC(C)CC(C(=O)NC(CSCCC(NC(=O)CC(C)(C)C)C(=O)O)C(=O)O)c1ccc(NC(=O)Nc2ccc(O)cc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ FPR2 P25090 3/20 0.38
▸ FOLH1 Q04609 3/20 0.38
▸ ACE P12821 1/20 0.35
▸ LMNA P02545 2/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ NAALAD2 Q9Y3Q0 1/20 0.34
▸ MAPT P10636 2/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ ANPEP P15144 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ ATM Q13315 1/20 0.33

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
SCHEMBL7541658 1.00 FPR2 (0.38) FPR2FOLH1ACELMNAALDH1A1
SCHEMBL7542063 0.94 GAA (0.40) FPR2ACEMAPTSMN1; SMN2NPSR1
SCHEMBL7544141 0.94 GAA (0.40) FPR2ACEMAPTSMN1; SMN2NPSR1
SCHEMBL7541488 0.94 FOLH1 (0.40) FOLH1ACENAALAD2
SCHEMBL7545839 0.93 ACE (0.39) FPR2ACELMNAALDH1A1MAPT
SCHEMBL7539858 0.93 ACE (0.39) FPR2ACELMNAALDH1A1MAPT
SCHEMBL7542841 0.92 ACE (0.40) FPR2FOLH1ACELMNAALDH1A1
SCHEMBL7540040 0.91 ANPEP (0.46) FPR2ACELMNASMN1; SMN2ANPEP
SCHEMBL7545670 0.91 ANPEP (0.46) FPR2ACELMNASMN1; SMN2ANPEP
SCHEMBL7543904 0.90 ACE (0.43) FPR2ACELMNAALDH1A1MAPT

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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