SCHEMBL7541819

SCHEMBL7541819

CC(C)CC(C(=O)NC(Cc1ccccc1CC(NC(=O)CC(C)(C)C)C(=O)O)C(=O)O)c1ccc(NC(=O)Nc2ccc(O)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 2/20 0.41
▸ FOLH1 Q04609 2/20 0.41
▸ REN P00797 1/20 0.40
▸ GAA P10253 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ MMP9 P14780 3/20 0.39
▸ MMP2 P08253 2/20 0.39
▸ MMP7 P09237 1/20 0.39
▸ MMP12 P39900 1/20 0.39
▸ MMP13 P45452 1/20 0.39
▸ MMP8 P22894 2/20 0.39
▸ FPR2 P25090 3/20 0.39
▸ MME P08473 1/20 0.38
▸ MMP1 P03956 1/20 0.38
▸ ECE1 P42892 2/20 0.37
▸ CTSS P25774 1/20 0.37
▸ CTSK P43235 1/20 0.37

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
SCHEMBL7546445 0.95 GAA (0.44) ACERENGAAMAPTHPGD
SCHEMBL7547224 0.93 SMN1; SMN2 (0.41) RENGAAMAPTHPGDRAB9A
SCHEMBL7544077 0.92 MAPK1 (0.42) RENGAAMAPTHPGDRAB9A
SCHEMBL7544754 0.91 FPR2 (0.49) RENRAB9AMMP9MMP2FPR2
SCHEMBL7546030 0.89 MEN1 (0.42) RENMAPTMMP2FPR2MMP1
SCHEMBL7569173 0.89 CTSK (0.41) ACEFOLH1RENGAAMAPT
SCHEMBL7549214 0.88 ACE (0.46) ACEFOLH1MMP9MMP2MMP7
SCHEMBL7540684 0.88 GAA (0.42) ACERENGAAMAPTHPGD
SCHEMBL7542028 0.88 FOLH1 (0.42) FOLH1GAAMAPTHPGDRAB9A
SCHEMBL7541822 0.88 ACE (0.37) ACEFOLH1RENGAAMAPT

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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