SCHEMBL3325713

SCHEMBL3325713

CCC(C)N1CCN(C(=O)C2CCC(Nc3ccc(OC(F)(F)F)cc3)CC2)CC1

nearest known ligand 0.55

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 13/20 0.55
HRH3 Q9Y5N1 6/20 0.48
POLB P06746 1/20 0.46

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
SCHEMBL3325715 1.00 EPHX2 (0.55) EPHX2HRH3POLB
SCHEMBL3326746 1.00 EPHX2 (0.55) EPHX2HRH3POLB
SCHEMBL3326242 0.90 EPHX2 (0.59) EPHX2
SCHEMBL3324081 0.90 EPHX2 (0.59) EPHX2
SCHEMBL3324084 0.90 EPHX2 (0.59) EPHX2
SCHEMBL3329332 0.85 EPHX2 (0.43) EPHX2HRH3
SCHEMBL3329336 0.85 EPHX2 (0.43) EPHX2HRH3
SCHEMBL3326536 0.80 EPHX2 (0.56) EPHX2
SCHEMBL3324161 0.80 EPHX2 (0.56) EPHX2
SCHEMBL3324162 0.80 EPHX2 (0.56) EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100120769-A1 CYCLOHEXYL PIPERAZINYL METHANONE DERIVATIVES NETTEKOVEN MATTHIAS 2010-05-13 US disclosed
CN-101374825-A Cyclohexyl piperazinyl methanone derivatives and their use as histamine h3 receptor modulators HOFFMANN LA ROCHE (CH) 2009-02-25 CN 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 EPHX2 3709/4885HRH3 1/4885POLB 1288/4885
US-20070167436-A1 Cyclohexyl piperazinyl methanone derivatives HRH3, HRH4, HRH1 EPHX2 3709/4885HRH3 1/4885POLB 1288/4885

“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.