SCHEMBL8905162

SCHEMBL8905162

Cn1c(-c2ccccc2)c(C=CC(=O)O)c2ccccc2c1=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.46
ALDH1A1 P00352 2/20 0.46
CYP2C19 P33261 1/20 0.41
HSD17B10 Q99714 1/20 0.41
GABRA1 P14867 1/20 0.40
GABRG2 P18507 1/20 0.40
GABRB3 P28472 1/20 0.40
GABRA3 P34903 1/20 0.40
NPC1 O15118 3/20 0.40
RAB9A P51151 3/20 0.40
BRD4 O60885 1/20 0.40
TACR1 P25103 1/20 0.39
HDAC6 Q9UBN7 2/20 0.39
HDAC3 O15379 1/20 0.39
TNKS O95271 1/20 0.39
HDAC4 P56524 1/20 0.39
HDAC1 Q13547 1/20 0.39
HCAR2 Q8TDS4 1/20 0.39
HDAC7 Q8WUI4 1/20 0.39
HDAC2 Q92769 1/20 0.39

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
SCHEMBL8662656 1.00 LMNA (0.46) LMNAALDH1A1CYP2C19HSD17B10GABRA1
SCHEMBL8659050 0.86 DPP4 (0.46) LMNAALDH1A1GABRA1GABRG2GABRB3
SCHEMBL8903556 0.86 DPP4 (0.46) LMNAALDH1A1GABRA1GABRG2GABRB3
SCHEMBL6490375 0.84 ALDH1A1 (0.66) LMNAALDH1A1CYP2C19HSD17B10NPC1
SCHEMBL6490384 0.84 ALDH1A1 (0.66) LMNAALDH1A1CYP2C19HSD17B10NPC1
SCHEMBL8659535 0.80 ALDH1A1 (0.69) LMNAALDH1A1CYP2C19HSD17B10GABRA1
SCHEMBL6478007 0.79 ABCB1 (0.48) LMNAALDH1A1CYP2C19HSD17B10NPC1
SCHEMBL6478016 0.79 ABCB1 (0.48) LMNAALDH1A1CYP2C19HSD17B10NPC1
SCHEMBL9763854 0.77 TACR1 (0.47) LMNATACR1SMN1; SMN2KMT2APADI4
SCHEMBL9763860 0.77 TACR1 (0.47) LMNATACR1SMN1; SMN2KMT2APADI4

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-5665733-A 3-phenylisoquinol-1(2H)-one derivatives their preparation and their therapeutic application SYNTHELABO (FR) 1997-09-09 US disclosed