SCHEMBL10790675

SCHEMBL10790675

Nc1ccc(-n2nccc2O)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.44
CYP2C9 P11712 7/20 0.40
CYP2C18 P33260 7/20 0.40
LMNA P02545 3/20 0.40
CYP3A4 P08684 2/20 0.40
HSD17B10 Q99714 2/20 0.40
CYP2C19 P33261 2/20 0.40
TSHR P16473 2/20 0.40
NFKB1 P19838 1/20 0.40
THPO P40225 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
MAPT P10636 3/20 0.38
CYP2C8 P10632 6/20 0.38
ALDH1A1 P00352 3/20 0.37
CA3 P07451 1/20 0.37
THRB P10828 1/20 0.37
ALOX15 P16050 1/20 0.37
CA6 P23280 1/20 0.37
CASP1 P29466 1/20 0.37

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
SCHEMBL23401516 0.79 ALDH1A1 (0.44) CYP2C9CYP2C18LMNACYP3A4CYP2C19
SCHEMBL14696217 0.79 KDM4E (0.42) POLBMEN1KMT2A
SCHEMBL29829749 0.78 MAPK9 (0.42) POLBCYP2C9LMNAMAPTALDH1A1
SCHEMBL5579308 0.78 POLB (0.57) POLBCYP2C9CYP2C18LMNACYP3A4
SCHEMBL20001726 0.75 HIF1A (0.41) POLBHSD17B10CYP2C19TDP1MAPT
SCHEMBL15293588 0.73 LMNA (0.45) POLBCYP2C9CYP2C18LMNACYP3A4
SCHEMBL1630310 0.71 MEN1 (0.40) POLBCYP3A4HSD17B10MAPTALDH1A1
SCHEMBL4886599 0.71 KDM4E (0.47) POLBCYP2C9CYP2C18LMNACYP3A4
SCHEMBL23399161 0.71 ALDH1A1 (0.45) CYP2C9LMNACYP3A4HSD17B10CYP2C19
SCHEMBL19240299 0.69 POLB (0.52) POLBCYP2C9CYP2C18LMNACYP3A4

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-4649194-A 1:2 metal complexes of a disazo compound having a 5-hydroxy-1-(aminophenyl)pyrazole coupling/diazo component radical and disazo compound having a 1-amino-8-hydroxynaphthalene coupling/diazo component SANDOZ LTD. (CH) 1987-03-10 US disclosed