SCHEMBL8668286

SCHEMBL8668286

Cc1ccccc1NC(=O)C1CC(C(=O)O)N(C(=O)CN)C1c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ITGB1 P05556 4/20 0.44
▸ ITGA5 P08648 3/20 0.44
▸ ITGA4 P13612 3/20 0.44
▸ ITGB3 P05106 2/20 0.44
▸ ITGAV P06756 2/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ PKM P14618 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ ACE P12821 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.39
▸ P2RX7 Q99572 1/20 0.37
▸ HPGD P15428 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
SCHEMBL8667007 0.85 POLB (0.44) L3MBTL1ALDH1A1LMNAACESMN1; SMN2
SCHEMBL8666332 0.81 ACE (0.54) ALDH1A1LMNAACE
SCHEMBL8671884 0.77 ACE (0.46) ACE
SCHEMBL8669414 0.74 SIGMAR1 (0.43) ACE
SCHEMBL8668940 0.70 ACE (0.41) ALDH1A1ACESMN1; SMN2
SCHEMBL8667711 0.69 ACE (0.41) ALDH1A1ACESMN1; SMN2
SCHEMBL2498591 0.69 ALDH1A1 (0.64) ITGB1ITGA5ITGA4ITGB3ITGAV
SCHEMBL8672106 0.68 LMNA (0.37) L3MBTL1ALDH1A1LMNAACE
SCHEMBL8671320 0.68 SIGMAR1 (0.41) ACESMN1; SMN2HPGD
SCHEMBL8668993 0.68 TSHR (0.44) L3MBTL1ALDH1A1LMNASMN1; SMN2HSD17B10

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
US-5707991-A TREATMENT OF NERVOUS SYSTEM DISORDERS, PARKINSON'S DISEASE RHONE-POULENC RORER S.A. (FR) 1998-01-13 — — US disclosed
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