SCHEMBL11815557

SCHEMBL11815557

CCN(CC)c1nc2cc(C(F)(F)F)c(Cl)c(N)c2n1C

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ PGK1 P00558 1/20 0.32
▸ PLA2G7 Q13093 1/20 0.30
▸ CRHR1 P34998 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
SCHEMBL11806977 0.79 HSD11B1 (0.34) KDM4EKMT2A
SCHEMBL11814233 0.78 XPO1 (0.30) —
SCHEMBL11814904 0.75 ABL1 (0.33) KMT2A
SCHEMBL11812366 0.74 ADRB2 (0.30) —
SCHEMBL11517572 0.73 KDM4E (0.40) KDM4EKMT2A
SCHEMBL11810909 0.72 GRM2 (0.35) —
SCHEMBL11811536 0.72 — —
SCHEMBL11807421 0.72 DPP4 (0.39) —
SCHEMBL11806966 0.72 TLR7 (0.31) —
SCHEMBL11817465 0.72 ADORA2A (0.40) —

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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