SCHEMBL9309615

SCHEMBL9309615

NC(=O)C1CC(O)CN1C(=O)c1ccc2c(c1)OCO2

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 6/20 0.51
ALDH1A1 P00352 5/20 0.49
HSD17B10 Q99714 2/20 0.48
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
MAPK1 P28482 1/20 0.46
NPC1 O15118 3/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
TP53 P04637 1/20 0.44
TSHR P16473 3/20 0.44
POLB P06746 1/20 0.43
RAB9A P51151 2/20 0.43
GAA P10253 1/20 0.43
GFER P55789 1/20 0.43
CASP3 P42574 1/20 0.42
SENP7 Q9BQF6 1/20 0.42
SCD O00767 1/20 0.42

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
SCHEMBL9310652 0.93 TSHR (0.51) HPGDALDH1A1HSD17B10SMN1; SMN2TSHR
SCHEMBL9034399 0.89 HPGD (0.52) HPGDALDH1A1HSD17B10CYP1A2CYP3A4
SCHEMBL9308729 0.82 HPGD (0.58) HPGDALDH1A1HSD17B10CYP1A2CYP3A4
SCHEMBL9310714 0.82 HPGD (0.62) HPGDALDH1A1HSD17B10CYP1A2CYP3A4
SCHEMBL9308604 0.81 ALDH1A1 (0.50) HPGDALDH1A1HSD17B10SMN1; SMN2TSHR
SCHEMBL8163043 0.79 ALDH1A1 (0.57) HPGDALDH1A1HSD17B10CYP1A2CYP3A4
SCHEMBL9308546 0.77 MEN1 (0.53) HPGDALDH1A1NPC1SMN1; SMN2TSHR
SCHEMBL108058 0.77 HPGD (0.59) HPGDALDH1A1HSD17B10CYP1A2CYP3A4
SCHEMBL9030080 0.76 UTS2R (0.45) HPGDALDH1A1NPC1POLBRAB9A
SCHEMBL21697319 0.76 MMP2 (0.50) ALDH1A1CYP1A2CYP3A4CYP2D6CYP2C9

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-5332735-A Antiamnesic activity ADIR ET COMPAGNIE (FR) 1994-07-26 US disclosed