SCHEMBL3324522

SCHEMBL3324522

O=C([C@H]1CC[C@H](Nc2ccc(F)cc2)CC1)N1CCN(C2CCC2)CC1

nearest known ligand 0.56

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 15/20 0.56
L3MBTL1 Q9Y468 1/20 0.49
KCNH2 Q12809 4/20 0.47

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
SCHEMBL3324520 1.00 HRH3 (0.56) HRH3L3MBTL1KCNH2
SCHEMBL3325886 1.00 HRH3 (0.56) HRH3L3MBTL1KCNH2
SCHEMBL3327455 0.97 HRH3 (0.53) HRH3L3MBTL1KCNH2
SCHEMBL3330189 0.96 HRH3 (0.52) HRH3L3MBTL1KCNH2
SCHEMBL3324027 0.96 HRH3 (0.52) HRH3L3MBTL1KCNH2
SCHEMBL3324024 0.96 HRH3 (0.52) HRH3L3MBTL1KCNH2
SCHEMBL3330185 0.96 HRH3 (0.52) HRH3L3MBTL1KCNH2
SCHEMBL3326101 0.89 MEN1 (0.48) HRH3
SCHEMBL3326099 0.89 MEN1 (0.48) HRH3
SCHEMBL3326452 0.88 LMNA (0.52) HRH3KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100120769-A1 CYCLOHEXYL PIPERAZINYL METHANONE DERIVATIVES NETTEKOVEN MATTHIAS 2010-05-13 US claimed
US-20070167436-A1 Cyclohexyl piperazinyl methanone derivatives HOFFMANN-LA ROCHE INC. 2007-07-19 US claimed
US-20100120769-A1 CYCLOHEXYL PIPERAZINYL METHANONE DERIVATIVES NETTEKOVEN MATTHIAS 2010-05-13 US disclosed
US-20070167436-A1 Cyclohexyl piperazinyl methanone derivatives HOFFMANN-LA ROCHE INC. 2007-07-19 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-20100120769-A1 CYCLOHEXYL PIPERAZINYL METHANONE DERIVATIVES HRH3, HRH4, HRH1 HRH3 1/4885L3MBTL1 3512/4885KCNH2 455/4885
US-20070167436-A1 Cyclohexyl piperazinyl methanone derivatives HRH3, HRH4, HRH1 HRH3 1/4885L3MBTL1 3512/4885KCNH2 455/4885

“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.