SCHEMBL11810909

SCHEMBL11810909

CCCn1c(CC)nc2cc(C(F)(F)F)c(Cl)c(N)c21

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ GRM2 Q14416 1/20 0.35
▸ DYRK1A Q13627 1/20 0.33
▸ CNR1 P21554 1/20 0.32
▸ CNR2 P34972 1/20 0.32
▸ POLB P06746 1/20 0.31
▸ AR P10275 1/20 0.30
▸ TLR7 Q9NYK1 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
SCHEMBL11806966 0.90 TLR7 (0.31) DYRK1ATLR7
SCHEMBL11809266 0.80 ABL1 (0.35) —
SCHEMBL11819659 0.80 — —
SCHEMBL11812366 0.79 ADRB2 (0.30) —
SCHEMBL11805651 0.79 CDK9 (0.40) DYRK1ACNR1CNR2
SCHEMBL11804036 0.78 TLR8 (0.38) DYRK1ACNR1CNR2POLB
SCHEMBL11517572 0.78 KDM4E (0.40) DYRK1A
SCHEMBL11810702 0.76 CTSS (0.33) —
SCHEMBL11814233 0.75 XPO1 (0.30) —
SCHEMBL11812486 0.75 KMT2A (0.33) DYRK1A

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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