SCHEMBL7542294

SCHEMBL7542294

Cc1ccc(NC(=O)Nc2ccc(C(CC(C)C)C(=O)NC(CCCCC(NC(=O)CC(C)(C)C)C(=O)O)C(=O)O)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 1/20 0.41
▸ FPR2 P25090 3/20 0.40
▸ MAPT P10636 3/20 0.39
▸ IDO1 P14902 1/20 0.39
▸ SLC6A3 Q01959 1/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ ALDH1A1 P00352 3/20 0.38
▸ LMNA P02545 2/20 0.38
▸ GAA P10253 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ MAPK14 Q16539 1/20 0.37
▸ ANPEP P15144 1/20 0.36
▸ HTT P42858 1/20 0.36

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
SCHEMBL7544683 0.93 MAPT (0.45) MAPK1FPR2MAPTALDH1A1LMNA
SCHEMBL7542028 0.93 FOLH1 (0.42) MAPK1FPR2MAPTSMN1; SMN2ALDH1A1
SCHEMBL7539530 0.92 FOLH1 (0.45) MAPK1FPR2MAPTSLC6A3ALDH1A1
SCHEMBL7541814 0.90 MAPK1 (0.38) MAPK1FPR2MAPTIDO1SLC6A3
SCHEMBL7539439 0.90 ANPEP (0.50) FPR2SLC6A3SMN1; SMN2RAB9AANPEP
SCHEMBL7539858 0.89 ACE (0.39) MAPK1FPR2MAPTIDO1SMN1; SMN2
SCHEMBL7545839 0.89 ACE (0.39) MAPK1FPR2MAPTIDO1SMN1; SMN2
SCHEMBL7545845 0.89 MAPK1 (0.37) MAPK1FPR2MAPTIDO1SMN1; SMN2
SCHEMBL7541908 0.88 MEN1 (0.44) MAPK1FPR2MAPTSMN1; SMN2ALDH1A1
SCHEMBL7547224 0.88 SMN1; SMN2 (0.41) MAPK1FPR2MAPTSMN1; SMN2ALDH1A1

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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