SCHEMBL7459691

SCHEMBL7459691

CCOC(=O)CNC(=O)N(CC(=O)OCC)Cc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.59
PPID Q08752 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
PIN1 Q13526 1/20 0.49
LMNA P02545 3/20 0.46
KMT2A Q03164 1/20 0.46
POLB P06746 1/20 0.44
HSD17B10 Q99714 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
LTA4H P09960 2/20 0.43
TP53 P04637 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
TRPM8 Q7Z2W7 1/20 0.43
LPAR1 Q92633 1/20 0.43

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
SCHEMBL5941081 0.84 PIN1 (0.56) ALDH1A1PPIDSMN1; SMN2PIN1LMNA
SCHEMBL9686760 0.83 PIN1 (0.53) ALDH1A1PPIDSMN1; SMN2PIN1LMNA
SCHEMBL15173708 0.81 PIN1 (0.54) ALDH1A1PPIDSMN1; SMN2PIN1LMNA
SCHEMBL3213534 0.81 ALDH1A1 (0.55) ALDH1A1SMN1; SMN2PIN1LMNAPOLB
SCHEMBL24339819 0.81 PIN1 (0.51) ALDH1A1PPIDSMN1; SMN2PIN1LMNA
SCHEMBL16109415 0.81 CTSS (0.62) ALDH1A1PPIDSMN1; SMN2PIN1
SCHEMBL7745572 0.80 CTSL (0.53) ALDH1A1PPIDSMN1; SMN2PIN1LMNA
SCHEMBL15173707 0.80 PIN1 (0.53) ALDH1A1PPIDSMN1; SMN2PIN1LMNA
SCHEMBL691909 0.80 SMN1; SMN2 (0.56) ALDH1A1SMN1; SMN2PIN1LMNAPOLB
SCHEMBL22144166 0.80 PIN1 (0.50) ALDH1A1PPIDSMN1; SMN2PIN1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0718290-B1 Carboxyalkyl heterocyclic derivatives NIPPON ZOKI PHARMACEUTICAL CO (JP) 2002-04-17 EP disclosed
US-5912261-A ANTIDIABETIC AGENTS NIPPON ZOKI PHARMACEUTICAL CO., LTD. (JP) 1999-06-15 US disclosed
EP-0718290-A1 Carboxyalkyl heterocyclic derivatives NIPPON ZOKI PHARMACEUTICAL CO., LTD. (JP) 1996-06-26 EP disclosed