SCHEMBL7541870

SCHEMBL7541870

CC(C)CC(C(=O)NC(Cc1ccc(CCC(=O)O)cc1)C(=O)O)c1ccc(NC(=O)Nc2ccccc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ FOLH1 Q04609 1/20 0.54
▸ MMP3 P08254 2/20 0.52
▸ MMP2 P08253 2/20 0.51
▸ ACE P12821 3/20 0.49
▸ MME P08473 2/20 0.49
▸ CPA1 P15085 2/20 0.49
▸ ACE2 Q9BYF1 2/20 0.49
▸ MMP9 P14780 2/20 0.48
▸ MMP8 P22894 1/20 0.48
▸ MAPT P10636 1/20 0.48
▸ FPR2 P25090 7/20 0.47
▸ ITGB1 P05556 1/20 0.46
▸ ITGA4 P13612 1/20 0.46
▸ MMP7 P09237 1/20 0.45
▸ MMP12 P39900 1/20 0.45
▸ MMP13 P45452 1/20 0.45

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
SCHEMBL7538785 1.00 FOLH1 (0.54) FOLH1MMP3MMP2ACEMME
SCHEMBL7546158 0.93 FOLH1 (0.53) FOLH1MMP3MMP2ACEMME
SCHEMBL7547257 0.93 FOLH1 (0.55) FOLH1MMP3MMP2ACEMME
SCHEMBL7547307 0.92 FOLH1 (0.52) FOLH1MMP3MMP2ACEMME
SCHEMBL7540008 0.92 MMP3 (0.50) FOLH1MMP3MMP2ACEMME
SCHEMBL7544917 0.91 FPR2 (0.56) FOLH1MMP3MMP2MMP9FPR2
SCHEMBL7545943 0.89 FOLH1 (0.48) FOLH1MMP3MMP2ACEMME
SCHEMBL7541912 0.87 MME (0.48) FOLH1MMP3MMP2ACEMME
SCHEMBL7543503 0.86 MMP3 (0.45) FOLH1MMP3MMP2ACEMME
SCHEMBL7543498 0.86 MMP3 (0.45) FOLH1MMP3MMP2ACEMME

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1376143-A Carboxylic acid derivatives and adhesion molecule inhibitors containing the same as the active ingredient TORAY INDUSTRIES (JP) 2002-10-23 — — CN disclosed
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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