SCHEMBL20078583

SCHEMBL20078583

NNC(=O)c1ccccccccc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.62
MPO P05164 2/20 0.62
GAA P10253 1/20 0.62
KDM5A P29375 1/20 0.62
BLM P54132 1/20 0.62
GFER P55789 1/20 0.62
PMP22 Q01453 1/20 0.62
HIF1A Q16665 1/20 0.62
ALOX15 P16050 2/20 0.61
CA1 P00915 2/20 0.61
CA9 Q16790 2/20 0.61
HDAC3 O15379 1/20 0.61
CA12 O43570 1/20 0.61
IDO1 P14902 1/20 0.61
HDAC1 Q13547 1/20 0.61
HDAC7 Q8WUI4 1/20 0.61
HDAC2 Q92769 1/20 0.61
HSD17B10 Q99714 1/20 0.61
HDAC8 Q9BY41 1/20 0.61
HDAC6 Q9UBN7 1/20 0.61

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
Benzoic Acid Hydrazide SCHEMBL4515671 1.00 CYP3A4 (0.62) CYP3A4MPOGAAKDM5ABLM
Benzoic Acid Hydrazide SCHEMBL83514 1.00 CYP3A4 (0.62) CYP3A4MPOGAAKDM5ABLM
Benzoic Acid Hydrazide SCHEMBL6469726 0.97 CYP3A4 (0.60) CYP3A4MPOGAAKDM5ABLM
Benzoic Acid Hydrazide SCHEMBL922906 0.97 CYP3A4 (0.60) CYP3A4MPOGAAKDM5ABLM
Benzoic Acid Hydrazide SCHEMBL28488364 0.97 CYP3A4 (0.60) CYP3A4MPOGAAKDM5ABLM
Benzoic Acid Hydrazide SCHEMBL1128823 0.97 CYP3A4 (0.60) CYP3A4MPOGAAKDM5ABLM
Benzoic Acid Hydrazide SCHEMBL31087636 0.97 CYP3A4 (0.60) CYP3A4MPOGAAKDM5ABLM
Benzoic Acid Hydrazide SCHEMBL31491462 0.97 CYP3A4 (0.60) CYP3A4MPOGAAKDM5ABLM
Benzoic Acid Hydrazide SCHEMBL490987 0.97 CYP3A4 (0.60) CYP3A4MPOGAAKDM5ABLM
Benzoic Acid Hydrazide SCHEMBL29999087 0.97 CYP3A4 (0.60) CYP3A4MPOGAAKDM5ABLM

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-9951045-B2 Indazole compounds as 5-HT4 receptor agonists SUVEN LIFE SCIENCES LIMITED (IN) 2018-04-24 US disclosed