SCHEMBL8026459

SCHEMBL8026459

C=CCc1nc(=O)cc[nH]1

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ SRD5A1 P18405 1/20 0.31
▸ NPSR1 Q6W5P4 1/20 0.31

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
SCHEMBL5823571 0.69 ADRA2B (0.31) NPSR1
SCHEMBL11757417 0.69 ALDH1A1 (0.39) NPSR1
SCHEMBL1110848 0.69 MEN1 (0.44) —
SCHEMBL7553558 0.68 — —
SCHEMBL27856952 0.68 GPR84 (0.46) NPSR1
SCHEMBL11317 0.67 — —
Ammonia Solution, Strong SCHEMBL8665541 0.65 — —
Hydrochloric Acid SCHEMBL29101117 0.65 ALOX15 (0.44) —
Hydrochloric Acid SCHEMBL3806550 0.65 — —
SCHEMBL10484488 0.65 — —

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-6100257-A 2-HALOALKYL,3-(HALOALKYL, ALKENYL, OR ALKYNYL),5-(SUBSTITUTED PHENYL OR HETEROCYCLE),6-ALKYL-PYRIMIDIN-4-ONE COMPOUNDS OF GIVEN STRUCTURE; USE AS HERBICIDES SUMITOMO CHEMICAL COMPANY, LTD. (JP) 2000-08-08 — — US disclosed
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