SCHEMBL8793376

SCHEMBL8793376

NNc1ccc(-c2ccc(NN)c(O)c2)cc1O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.52
NPC1 O15118 1/20 0.52
POLB P06746 1/20 0.52
RAB9A P51151 1/20 0.52
ALOX15 P16050 2/20 0.48
HSD17B10 Q99714 2/20 0.48
CYP3A4 P08684 1/20 0.48
APP P05067 3/20 0.48
KIF11 P52732 1/20 0.43
ALOX5 P09917 5/20 0.41
QDPR P09417 3/20 0.37
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
USP2 O75604 1/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
HSP90AA1 P07900 1/20 0.35
GAA P10253 1/20 0.35
HPGD P15428 1/20 0.35
ALOX12 P18054 1/20 0.35

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
SCHEMBL28347412 0.80 ALDH1A1 (0.47) ALOX15CYP3A4ALOX5ALDH1A1CA1
SCHEMBL9505716 0.78 MAPT (0.38) MAPTNPC1POLBRAB9ACYP3A4
SCHEMBL29291587 0.76 CA9 (0.50) MAPTNPC1POLBKDM4EMEN1
SCHEMBL16761044 0.76 ALOX15 (0.44) ALOX15KDM4EALDH1A1GAAHPGD
SCHEMBL29291586 0.76 TRPA1 (0.52) MAPTNPC1RAB9AALOX15HSD17B10
SCHEMBL29291588 0.76 ALDH1A1 (0.50) MAPTPOLBALOX15HSD17B10CYP3A4
SCHEMBL19491999 0.75 NPC1 (0.57) MAPTNPC1POLBRAB9AALOX15
SCHEMBL20227392 0.73 NPC1 (0.66) MAPTNPC1POLBRAB9AALOX15
SCHEMBL7928315 0.73 TTR (0.42) MAPTPOLBRAB9AALOX15HSD17B10
SCHEMBL21589350 0.72 ALDH1A1 (0.55) HSD17B10KDM4EALDH1A1LMNAHPGD

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-5591250-A POLYIMIDE MEMBRANE GAS RESEARCH INSTITUTE (US) 1997-01-07 US disclosed