SCHEMBL7470197

SCHEMBL7470197

OC(c1ccc(C(F)(F)F)cc1)(c1ccc(C(F)(F)F)cc1)C1CCN(Cc2ccc(-c3ccccn3)cc2)CC1

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 2/20 0.61
HRH1 P35367 1/20 0.54
DNMT1 P26358 1/20 0.53
EHMT2 Q96KQ7 1/20 0.53
CYP3A4 P08684 1/20 0.47
BCHE P06276 2/20 0.47
ACHE P22303 2/20 0.47
BACE1 P56817 2/20 0.47
SIGMAR1 Q99720 2/20 0.46
MCHR1 Q99705 1/20 0.46
CHRM4 P08173 1/20 0.45
NPY2R P49146 1/20 0.44
TRPV1 Q8NER1 1/20 0.44

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
SCHEMBL7469624 0.88 KCNH2 (0.61) KCNH2HRH1DNMT1EHMT2CYP3A4
SCHEMBL7994384 0.85 KCNH2 (0.53) KCNH2HRH1DNMT1EHMT2MCHR1
SCHEMBL7467030 0.82 DNMT1 (0.53) KCNH2HRH1DNMT1EHMT2CYP3A4
Hydrochloric Acid SCHEMBL8200558 0.81 KCNH2 (0.67) KCNH2HRH1DNMT1EHMT2BCHE
SCHEMBL7472545 0.81 DNMT1 (0.58) KCNH2HRH1DNMT1EHMT2CYP3A4
SCHEMBL7464967 0.75 DNMT1 (0.54) KCNH2HRH1DNMT1EHMT2CYP3A4
SCHEMBL7995588 0.75 DNMT1 (0.56) KCNH2HRH1DNMT1EHMT2
SCHEMBL7469010 0.74 DNMT1 (0.53) KCNH2HRH1DNMT1EHMT2BCHE
SCHEMBL7470504 0.74 KCNH2 (0.52) KCNH2HRH1DNMT1EHMT2BCHE
SCHEMBL7472446 0.74 DNMT1 (0.58) KCNH2HRH1DNMT1EHMT2

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0844825-B1 INSECTICIDAL N-(SUBSTITUTED ARYLMETHYL)-4- BIS(SUBSTITUTED PHENYL OR PYRIDYL)METHYL]PIPERIDINES FMC CORP (US) 2002-11-27 EP claimed
EP-0844825-A4 INSECTICIDAL N-(SUBSTITUTED ARYLMETHYL)-4- BIS(SUBSTITUTED PHENYL OR PYRIDYL)METHYL]PIPERIDINES FMC CORP (US) 2000-04-05 EP claimed
US-6030987-A Insecticidal N-(substituted arylmethyl)-4-[bis(substituted phenyl or pyridyl)methyl]piperidines FMC CORPORATION (US) 2000-02-29 US claimed
EP-0844825-A1 INSECTICIDAL N-(SUBSTITUTED ARYLMETHYL)-4- BIS(SUBSTITUTED PHENYL OR PYRIDYL)METHYL]PIPERIDINES FMC CORPORATION (US) 1998-06-03 EP claimed
WO-1996036228-A1 INSECTICIDAL N-(SUBSTITUTED ARYLMETHYL)-4-[BIS(SUBSTITUTED PHENYL OR PYRIDYL)METHYL]PIPERIDINES FMC CORPORATION (US) 1996-11-21 WO claimed