SCHEMBL5466684

SCHEMBL5466684

CN1CCN(C(=O)NCc2ccccc2C(F)(F)F)CC1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 11/20 0.53
CYP2C9 P11712 4/20 0.53
POLB P06746 2/20 0.53
KDM4E B2RXH2 2/20 0.53
ALDH1A1 P00352 2/20 0.53
TSHR P16473 1/20 0.53
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
CYP3A4 P08684 2/20 0.52
CYP2D6 P10635 1/20 0.51
CYP2C19 P33261 1/20 0.51
P2RX7 Q99572 1/20 0.48

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
SCHEMBL2260400 0.86 EPHX2 (0.75) EPHX2CYP2C9CYP3A4CYP2D6CYP2C19
SCHEMBL5465081 0.81 KMT2A (0.61) EPHX2KDM4EALDH1A1MEN1KMT2A
SCHEMBL5468451 0.80 MEN1 (0.56) EPHX2ALDH1A1MEN1KMT2AP2RX7
SCHEMBL4983338 0.78 SIGMAR1 (0.55) EPHX2CYP2C9POLBKDM4EALDH1A1
SCHEMBL16269121 0.78 P2RX7 (0.53) EPHX2CYP2C9POLBKDM4EALDH1A1
SCHEMBL5471711 0.77 PKM (0.69) KDM4EMEN1KMT2A
SCHEMBL16269460 0.76 EPHX2 (0.56) EPHX2CYP2C9KDM4EALDH1A1CYP3A4
SCHEMBL5471150 0.76 MEN1 (0.75) KDM4EALDH1A1MEN1KMT2A
SCHEMBL5464853 0.76 MEN1 (0.70) EPHX2KDM4EMEN1KMT2AP2RX7
SCHEMBL5476543 0.75 MEN1 (0.56) KDM4EALDH1A1MEN1KMT2A

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-20070249618-A1 Novel Piperidine Derivatives as Histamine H3 Receptor Ligands for Treatment of Depression ASTRAZENECA AB (SE) 2007-10-25 US disclosed
US-20070249618-A1 Novel Piperidine Derivatives as Histamine H3 Receptor Ligands for Treatment of Depression ASTRAZENECA AB (SE) 2007-10-25 US disclosed
US-20070249618-A1 Novel Piperidine Derivatives as Histamine H3 Receptor Ligands for Treatment of Depression ASTRAZENECA AB (SE) 2007-10-25 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-20070249618-A1 Novel Piperidine Derivatives as Histamine H3 Receptor Ligands for Treatment of Depression HRH3, HRH1, HRH4 EPHX2 2049/4885CYP2C9 3124/4885POLB 3518/4885

“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.