SCHEMBL11811344

SCHEMBL11811344

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

nearest known ligand 0.30

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ DHFR P00374 1/20 0.30
▸ SLC2A1 P11166 1/20 0.30
▸ ABL1 P00519 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
SCHEMBL11804027 0.89 DHFR (0.32) DHFRSLC2A1
SCHEMBL11809102 0.87 CSNK1E (0.36) ABL1
SCHEMBL11811136 0.87 BRD4 (0.36) ABL1
SCHEMBL11867426 0.81 EPAS1 (0.32) ABL1
SCHEMBL11517572 0.80 KDM4E (0.40) —
SCHEMBL11812652 0.79 CHRNB2 (0.36) —
SCHEMBL11819659 0.79 — —
SCHEMBL11811550 0.78 ADRB2 (0.30) —
SCHEMBL11806977 0.78 HSD11B1 (0.34) ABL1
SCHEMBL11810702 0.77 CTSS (0.33) —

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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