SCHEMBL16121401

SCHEMBL16121401

Fc1cc(F)c2[nH]c(-c3ccc(C(F)(F)F)nc3)nc2c1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PIK3CD O00329 1/20 0.40
▸ PIK3CA P42336 1/20 0.40
▸ PIK3CB P42338 1/20 0.40
▸ PI4KA P42356 1/20 0.40
▸ PIK3CG P48736 1/20 0.40
▸ PI4KB Q9UBF8 1/20 0.40
▸ NPBWR1 P48145 1/20 0.38
▸ PTGES O14684 4/20 0.37
▸ SCD O00767 1/20 0.36
▸ CYP11B1 P15538 1/20 0.36
▸ TRPV1 Q8NER1 1/20 0.36
▸ DGAT1 O75907 1/20 0.36
▸ TRPV3 Q8NET8 2/20 0.35

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
SCHEMBL16121162 0.78 KDM4E (0.55) PIK3CDPIK3CAPIK3CBPI4KAPIK3CG
SCHEMBL16121160 0.75 KDM4E (0.45) PIK3CDPIK3CAPIK3CBPI4KAPIK3CG
SCHEMBL16121404 0.74 NPC1 (0.46) PIK3CDPIK3CAPIK3CBPI4KAPIK3CG
SCHEMBL16102119 0.72 NPC1 (0.62) DGAT1
SCHEMBL28818932 0.70 PIK3CA (0.41) PIK3CDPIK3CAPIK3CBPI4KAPIK3CG
SCHEMBL16121405 0.69 CHEK2 (0.47) PIK3CDPIK3CAPIK3CBPI4KAPIK3CG
SCHEMBL1720841 0.69 PIK3CA (0.42) PIK3CDPIK3CAPIK3CBPI4KAPIK3CG
SCHEMBL16121415 0.68 TRPV1 (0.63) NPBWR1TRPV1DGAT1
SCHEMBL2711227 0.67 DHODH (0.39) PIK3CDPIK3CAPIK3CBPI4KAPIK3CG
SCHEMBL14235503 0.67 NPBWR1 (0.41) NPBWR1TRPV1DGAT1

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
WO-2014149207-A2 BENZIMIDAZOLE-BASED INSECTICIDAL COMPOSITIONS AND RELATED METHODS DOW AGROSCIENCES LLC (US) 2014-09-25 — — WO disclosed
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