SCHEMBL9783790

SCHEMBL9783790

C=CCB(c1ccccc1)c1ccccc1.CCc1cc(F)cc(Cc2ncc(-c3ccccc3)[nH]2)c1

nearest known ligand 0.41

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ HPGDS O60760 2/20 0.41
▸ PDE10A Q9Y233 8/20 0.39
▸ BRS3 P32247 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
SCHEMBL9783553 0.91 SCN2A (0.38) HPGDSPDE10A
SCHEMBL9783511 0.81 TAAR1 (0.44) —
SCHEMBL9783796 0.77 HPGDS (0.44) HPGDSPDE10ABRS3
SCHEMBL9783999 0.72 — —
SCHEMBL9783003 0.71 BRS3 (0.37) HPGDSBRS3
SCHEMBL9783990 0.70 HPGDS (0.45) HPGDSPDE10ABRS3
SCHEMBL9783609 0.69 BRS3 (0.33) HPGDSBRS3
SCHEMBL9783561 0.69 SCN2A (0.37) HPGDSPDE10A
SCHEMBL1501900 0.66 PDE10A (0.64) HPGDSPDE10A
SCHEMBL9783770 0.65 TAAR1 (0.45) —

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5051514-A Complexing boranes and imidazoles CHEVRON RESEARCH AND TECHNOLOGY COMPANY (US) 1991-09-24 — — US disclosed
EP-0432987-A2 Fungicidal organoborane imidazole compounds and intermediates therefor CHEVRON RESEARCH AND TECHNOLOGY COMPANY (US) 1991-06-19 — — EP disclosed
US-4983589-A Fungicidal imidazole diphenylaliphaticboranes and derivatives thereof CHEVRON RESEARCH AND TECHNOLOGY COMPANY (US) 1991-01-08 — — US disclosed
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