SCHEMBL4938232

SCHEMBL4938232

CN(C)Cc1ccc(N2CCC(CN3CCCC3)CC2)c(F)c1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 2/20 0.43
CHEK1 O14757 1/20 0.41
MAP2K1 Q02750 1/20 0.41
HRH3 Q9Y5N1 3/20 0.40
RORC P51449 1/20 0.40
MAPT P10636 3/20 0.37
GAA P10253 1/20 0.37
ALDH1A1 P00352 3/20 0.37
HTT P42858 1/20 0.37
HPGD P15428 2/20 0.36
TSHR P16473 1/20 0.36
THRB P10828 1/20 0.36
RAB9A P51151 1/20 0.36

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
SCHEMBL10263957 0.86 MAPT (0.42) MAPTGAAALDH1A1HTTHPGD
SCHEMBL4939123 0.84 ALDH1A1 (0.56) PARP1HRH3ALDH1A1HTT
SCHEMBL15759211 0.81 THRB (0.47) MAPTGAAALDH1A1HPGDTSHR
SCHEMBL4937638 0.79 HRH3 (0.49) HRH3GAA
SCHEMBL10263959 0.79 MAPT (0.38) MAPTGAAALDH1A1HTTHPGD
SCHEMBL10203135 0.78 APP (0.42) HRH3MAPTGAAALDH1A1HPGD
SCHEMBL10264296 0.76 PARP1 (0.42) PARP1MAPTGAAALDH1A1HPGD
SCHEMBL4935776 0.75 MEN1 (0.48) PARP1HRH3ALDH1A1HTT
SCHEMBL4939884 0.75 ALDH1A1 (0.68) MAPTGAAALDH1A1HTTHPGD
SCHEMBL8250761 0.75 HTR6 (0.45) PARP1CHEK1MAP2K1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1556046-A1 PHENYLPIPERIDINES AND PHENYLPYRROLIDINES AS HISTAMINE H3 RECEPTOR MODULATORS Janssen Pharmaceutica N.V. (BE) 2005-07-27 EP claimed
US-20040087573-A1 Phenylpiperidines and phenylpyrrolidines JANSSEN PHARMACEUTICA N.V. (BE) 2004-05-06 US claimed
WO-2004037257-A1 PHENYLPIPERIDINES AND PHENYLPYRROLIDINES AS HISTAMINE H3 RECEPTOR MODULATORS JANSSEN PHARMACEUTICA, N.V. (BE) 2004-05-06 WO claimed
US-20080004314-A1 Phenylpiperidines and Phenylpyrrolidines APODACA RICHARD L 2008-01-03 US disclosed
US-20080004314-A1 Phenylpiperidines and Phenylpyrrolidines APODACA RICHARD L 2008-01-03 US disclosed
US-20080004314-A1 Phenylpiperidines and Phenylpyrrolidines APODACA RICHARD L 2008-01-03 US disclosed
US-7279491-B2 Phenylpiperidines and phenylpyrrolidines JANSSEN PHARMACEUTICA N.V. (BE) 2007-10-09 US disclosed
US-7279491-B2 Phenylpiperidines and phenylpyrrolidines JANSSEN PHARMACEUTICA N.V. (BE) 2007-10-09 US disclosed
US-7279491-B2 Phenylpiperidines and phenylpyrrolidines JANSSEN PHARMACEUTICA N.V. (BE) 2007-10-09 US disclosed
EP-1556046-A1 PHENYLPIPERIDINES AND PHENYLPYRROLIDINES AS HISTAMINE H3 RECEPTOR MODULATORS Janssen Pharmaceutica N.V. (BE) 2005-07-27 EP disclosed
US-20040087573-A1 Phenylpiperidines and phenylpyrrolidines JANSSEN PHARMACEUTICA N.V. (BE) 2004-05-06 US disclosed
WO-2004037257-A1 PHENYLPIPERIDINES AND PHENYLPYRROLIDINES AS HISTAMINE H3 RECEPTOR MODULATORS JANSSEN PHARMACEUTICA, N.V. (BE) 2004-05-06 WO 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 (2 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-20040087573-A1 Phenylpiperidines and phenylpyrrolidines HRH2, HNMT, HRH3 PARP1 1685/4885CHEK1 4214/4885MAP2K1 4112/4885
US-20080004314-A1 Phenylpiperidines and Phenylpyrrolidines HRH2, HNMT, HRH3 PARP1 1685/4885CHEK1 4214/4885MAP2K1 4112/4885

“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.