SCHEMBL4937801

SCHEMBL4937801

FC(F)(F)c1cc(CN2CCC(N3CCCC3)CC2)ccc1N1CCC(CN2CCCC2)CC1

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
L3MBTL3 Q96JM7 11/20 0.50
L3MBTL1 Q9Y468 10/20 0.50
MBTD1 Q05BQ5 4/20 0.49
TP53BP1 Q12888 2/20 0.49
CYP2C9 P11712 1/20 0.40
HRH3 Q9Y5N1 1/20 0.39
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 2/20 0.38
WDR5 P61964 1/20 0.38
GAA P10253 1/20 0.38

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
SCHEMBL4933545 0.91 ALDH1A1 (0.46) L3MBTL3L3MBTL1CYP2C9HRH3KDM4E
SCHEMBL4937138 0.88 HRH3 (0.43) CYP2C9HRH3KDM4EALDH1A1WDR5
SCHEMBL10263755 0.79 L3MBTL3 (0.43) L3MBTL3L3MBTL1MBTD1TP53BP1CYP2C9
SCHEMBL4939123 0.76 ALDH1A1 (0.56) L3MBTL3L3MBTL1MBTD1TP53BP1HRH3
SCHEMBL4941322 0.74 PARP1 (0.43) L3MBTL3L3MBTL1MBTD1TP53BP1HRH3
SCHEMBL4937515 0.74 ALDH1A1 (0.46) CYP2C9HRH3ALDH1A1GAA
SCHEMBL14282077 0.73 HRH3 (0.44) L3MBTL3L3MBTL1MBTD1TP53BP1HRH3
SCHEMBL10157709 0.73 MAPT (0.47) L3MBTL3L3MBTL1MBTD1HRH3KDM4E
SCHEMBL15759210 0.73 L3MBTL3 (0.45) L3MBTL3L3MBTL1MBTD1HRH3KDM4E
SCHEMBL4937299 0.72 MAPT (0.46) L3MBTL3L3MBTL1MBTD1HRH3KDM4E

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
WO-2004037257-A1 PHENYLPIPERIDINES AND PHENYLPYRROLIDINES AS HISTAMINE H3 RECEPTOR MODULATORS JANSSEN PHARMACEUTICA, N.V. (BE) 2004-05-06 WO disclosed
US-20040087573-A1 Phenylpiperidines and phenylpyrrolidines JANSSEN PHARMACEUTICA N.V. (BE) 2004-05-06 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 (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 L3MBTL3 4833/4885L3MBTL1 4814/4885MBTD1 3982/4885
US-20080004314-A1 Phenylpiperidines and Phenylpyrrolidines HRH2, HNMT, HRH3 L3MBTL3 4833/4885L3MBTL1 4814/4885MBTD1 3982/4885

“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.