SCHEMBL11812366

SCHEMBL11812366

CCn1c(Cl)nc2cc(C(F)(F)F)c(Cl)c(N)c21

nearest known ligand 0.30

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ ADRB2 P07550 2/20 0.30
▸ ADRB1 P08588 1/20 0.30
▸ CACNA1H O95180 1/20 0.30

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
SCHEMBL11517572 0.88 KDM4E (0.40) —
SCHEMBL11806966 0.86 TLR7 (0.31) —
SCHEMBL11810331 0.84 S1PR1 (0.34) —
SCHEMBL11814233 0.84 XPO1 (0.30) —
SCHEMBL11809266 0.84 ABL1 (0.35) ADRB2ADRB1
SCHEMBL11812193 0.84 MBOAT4 (0.32) —
SCHEMBL11810909 0.79 GRM2 (0.35) —
SCHEMBL11805651 0.78 CDK9 (0.40) ADRB2
SCHEMBL11813265 0.78 ALDH1A1 (0.36) —
SCHEMBL11811550 0.78 ADRB2 (0.30) ADRB2ADRB1

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-3954438-A 5-Trifluoromethyl-7-aminobenzimidazoles herbicides UNITED STATES BORAX & CHEMICAL CORPORATION (US) 1976-05-04 — — US disclosed
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