SCHEMBL9006013

SCHEMBL9006013

FC(F)(F)c1nc(-c2ccc(Cl)c(Cl)c2)c[nH]1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KIF20B Q96Q89 1/20 0.46
▸ AHR P35869 2/20 0.42
▸ KMO O15229 6/20 0.41
▸ NOTUM Q6P988 3/20 0.41
▸ TTR P02766 1/20 0.40
▸ NPC1 O15118 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ CYP1B1 Q16678 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ CRHBP P24387 1/20 0.37
▸ MC4R P32245 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ CRHR2 Q13324 1/20 0.37
▸ NPY5R Q15761 1/20 0.37

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
SCHEMBL2570966 0.83 NPC1 (0.42) KIF20BAHRKMONOTUMNPC1
SCHEMBL18041475 0.79 IDO1 (0.45) KMONOTUM
SCHEMBL23410559 0.77 KDM4E (0.44) NPC1RAB9ALMNAMEN1CRHBP
SCHEMBL19627018 0.74 AHR (0.46) AHRKMONOTUMNPC1RAB9A
SCHEMBL9080400 0.72 KDM4E (0.49) NPC1RAB9ALMNAHPGDMEN1
SCHEMBL9050978 0.72 KIF11 (0.47) NPC1RAB9A
SCHEMBL9048277 0.72 AHR (0.41) KIF20BAHRNOTUMNPC1RAB9A
SCHEMBL2944949 0.70 MAPK13 (0.49) AHRKMONOTUMNPC1RAB9A
SCHEMBL3557053 0.70 KMO (0.53) KIF20BAHRKMOTTRNPC1
SCHEMBL31305411 0.70 MAPK13 (0.49) AHRKMONOTUMNPC1RAB9A

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
EP-0736013-A1 N-SUBSTITUTED ARYL TRIFLUOROMETHYL IMIDAZOLES BAYER AG (DE) 1996-10-09 — — EP disclosed
WO-1995017390-A1 N-SUBSTITUTED ARYL TRIFLUOROMETHYL IMIDAZOLES BAYER AKTIENGESELLSCHAFT (DE) 1995-06-29 — — WO disclosed
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