SCHEMBL11264698

SCHEMBL11264698

OC(Cc1ccc(Cl)cc1Cl)(Cn1ccnc1)c1ccc(F)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FNTA P49354 5/20 0.48
FNTB P49356 5/20 0.48
PGGT1B P53609 2/20 0.48
OGG1 O15527 1/20 0.46
IDO1 P14902 3/20 0.44
CYP2C9 P11712 4/20 0.43
ADRA2C P18825 2/20 0.43
PGR P06401 2/20 0.43
CHRM2 P08172 2/20 0.43
CYP3A4 P08684 2/20 0.43
ADRA2A P08913 2/20 0.43
ADORA3 P0DMS8 2/20 0.43
CYP2D6 P10635 2/20 0.43
CHRM1 P11229 2/20 0.43
ADRB3 P13945 2/20 0.43
ADRA2B P18089 2/20 0.43
CHRM3 P20309 2/20 0.43
TACR2 P21452 2/20 0.43
DRD1 P21728 2/20 0.43
ACHE P22303 2/20 0.43

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
SCHEMBL11264045 0.93 OGG1 (0.49) FNTAFNTBPGGT1BOGG1IDO1
Nitric Acid SCHEMBL11276057 0.93 CYP3A4 (0.50) FNTAFNTBPGGT1BOGG1IDO1
Hydrochloric Acid SCHEMBL11266440 0.92 OGG1 (0.48) FNTAFNTBPGGT1BOGG1IDO1
SCHEMBL11264523 0.89 CYP11B1 (0.49) FNTAFNTBPGGT1BOGG1IDO1
SCHEMBL11260328 0.88 OGG1 (0.47) FNTAFNTBPGGT1BOGG1IDO1
SCHEMBL10813164 0.87 CYP19A1 (0.49) FNTAFNTBPGGT1BOGG1IDO1
SCHEMBL11266968 0.84 OGG1 (0.57) FNTAFNTBPGGT1BOGG1IDO1
Nitric Acid SCHEMBL11267258 0.83 CYP3A4 (0.50) FNTAFNTBPGGT1BOGG1IDO1
SCHEMBL11181390 0.83 OGG1 (0.55) FNTAFNTBPGGT1BOGG1IDO1
Nitric Acid SCHEMBL11269538 0.82 CYP3A4 (0.52) FNTAFNTBPGGT1BOGG1IDO1

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-4358458-A BACTERICIDE, FUNGICIDES NORDMARK-WERKE GMBH (DE) 1982-11-09 US disclosed