SCHEMBL3045219

SCHEMBL3045219

CN1CCC(N(C)C(=O)COc2ccc(OC(F)(F)F)cc2)CC1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 2/20 0.56
POLB P06746 1/20 0.55
CCR5 P51681 1/20 0.53
HTR6 P50406 1/20 0.50
GAA P10253 1/20 0.50
HTT P42858 1/20 0.50
MAPT P10636 2/20 0.49
HRH3 Q9Y5N1 2/20 0.48
KDM4E B2RXH2 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
MCHR1 Q99705 1/20 0.46
IDH1 O75874 2/20 0.46
APOBEC3A P31941 1/20 0.45
APOBEC3G Q9HC16 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
ATM Q13315 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
SCHEMBL3047425 0.86 MAPT (0.62) HTR2APOLBGAAHTTMAPT
SCHEMBL3048697 0.86 CCR5 (0.70) HTR2ACCR5HTR6KMT2A
SCHEMBL3038901 0.85 RAB9A (0.60) HTR2APOLBCCR5GAAHTT
SCHEMBL3047069 0.83 POLB (0.57) POLBGAAHTTMAPTKDM4E
SCHEMBL3047421 0.79 POLB (0.60) POLBHTR6HTTHRH3KDM4E
SCHEMBL3052139 0.77 CCR5 (0.57) HTR2ACCR5HTR6MEN1KMT2A
SCHEMBL15134818 0.77 HRH3 (0.71) POLBGAAHRH3MEN1KMT2A
SCHEMBL254551 0.75 ALDH1A1 (0.63) HTR2APOLBGAAMAPTMEN1
SCHEMBL2404203 0.75 CCR5 (0.65) CCR5HRH3L3MBTL1
SCHEMBL2056172 0.74 HTR2A (0.62) HTR2ACCR5HTR6GAAMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1434765-B1 SUBSTITUTED PIPERIDINES WITH SELECTIVE BINDING TO HISTAMINE H3-RECEPTOR HIGH POINT PHARMACEUTICALS LLC (US) 2009-12-02 EP claimed
US-20100222386-A1 SUBSTITUTED PIPERIDINES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-09-02 US disclosed
US-20100222386-A1 SUBSTITUTED PIPERIDINES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-09-02 US disclosed
US-20100222386-A1 SUBSTITUTED PIPERIDINES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-09-02 US disclosed
US-7767695-B2 Substituted piperidines HIGH POINT PHARMACEUTICALS, LLC (US) 2010-08-03 US disclosed
US-7767695-B2 Substituted piperidines HIGH POINT PHARMACEUTICALS, LLC (US) 2010-08-03 US disclosed
US-7767695-B2 Substituted piperidines HIGH POINT PHARMACEUTICALS, LLC (US) 2010-08-03 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100222386-A1 SUBSTITUTED PIPERIDINES HRH3, HRH4, HRH2 HTR2A 34/4885POLB 3476/4885CCR5 565/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.