SCHEMBL11811550

SCHEMBL11811550

CC(C)n1c(Cl)nc2cc(C(F)(F)F)c(Cl)c(N)c21

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ADRB2 P07550 1/20 0.30
▸ ADRB1 P08588 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
SCHEMBL11809102 0.88 CSNK1E (0.36) —
SCHEMBL11813005 0.86 MAP3K12 (0.32) —
SCHEMBL11819659 0.84 — —
SCHEMBL11811536 0.84 — —
SCHEMBL11810702 0.82 CTSS (0.33) —
SCHEMBL11811344 0.78 DHFR (0.30) —
SCHEMBL11862605 0.78 EPAS1 (0.35) —
SCHEMBL11812366 0.78 ADRB2 (0.30) ADRB2ADRB1
SCHEMBL11814904 0.77 ABL1 (0.33) —
SCHEMBL11804027 0.76 DHFR (0.32) —

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