SCHEMBL9416596

SCHEMBL9416596

CN(Cc1cccc(O)c1)C(=O)c1cccc(O)c1

nearest known ligand 0.83

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HSD17B2 P37059 17/20 0.83
HSD17B1 P14061 16/20 0.83
KMT2A Q03164 3/20 0.69
MEN1 O00255 2/20 0.69

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
SCHEMBL12495942 0.91 HSD17B2 (1.00) HSD17B2HSD17B1KMT2AMEN1
SCHEMBL9416649 0.89 HSD17B1 (0.71) HSD17B2HSD17B1KMT2AMEN1
SCHEMBL12688094 0.87 HSD17B2 (1.00) HSD17B2HSD17B1KMT2AMEN1
SCHEMBL12495845 0.84 HSD17B2 (1.00) HSD17B2HSD17B1
SCHEMBL19049387 0.81 HSD17B2 (0.61) HSD17B2HSD17B1
SCHEMBL17119847 0.81 HSD17B1 (0.57) HSD17B2HSD17B1KMT2AMEN1
SCHEMBL18773897 0.81 KMT2A (0.69) HSD17B2HSD17B1KMT2AMEN1
SCHEMBL12688057 0.80 HSD17B2 (1.00) HSD17B2HSD17B1
SCHEMBL11899205 0.79 HSD17B1 (0.56) HSD17B2HSD17B1KMT2AMEN1
SCHEMBL28897045 0.79 HSD17B1 (0.55) HSD17B2HSD17B1KMT2AMEN1

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
EP-0613879-A1 PHELLODENDRINE ANALOGS AND ALLERGY TYPE IV SUPPRESSOR CONTAINING THE SAME AS ACTIVE INGREDIENT TSUMURA & CO. (JP) 1994-09-07 EP disclosed