SCHEMBL5468451

SCHEMBL5468451

CN1CCN(C(=O)NCc2ccccc2Cl)CC1

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
NPC1 O15118 1/20 0.55
RAB9A P51151 1/20 0.55
GAA P10253 1/20 0.55
FAAH O00519 1/20 0.53
MAPK8 P45983 1/20 0.53
HTT P42858 1/20 0.52
P2RX7 Q99572 1/20 0.52
EPHX2 P34913 4/20 0.50
ALDH1A1 P00352 2/20 0.50
TP53 P04637 1/20 0.50
PKM P14618 1/20 0.49

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
SCHEMBL5464308 0.89 MEN1 (0.53) MEN1KMT2AGAAMAPK8P2RX7
SCHEMBL5477278 0.85 KMT2A (0.58) MEN1KMT2AMAPK8HTTP2RX7
SCHEMBL5465081 0.84 KMT2A (0.61) MEN1KMT2AGAAMAPK8HTT
SCHEMBL5471267 0.83 MAPK8 (0.56) MEN1KMT2AMAPK8EPHX2TP53
SCHEMBL14413553 0.82 EPHX2 (0.58) NPC1RAB9AEPHX2ALDH1A1PKM
SCHEMBL5471711 0.81 PKM (0.69) MEN1KMT2ANPC1RAB9AGAA
SCHEMBL5466684 0.80 EPHX2 (0.53) MEN1KMT2AP2RX7EPHX2ALDH1A1
SCHEMBL5471150 0.79 MEN1 (0.75) MEN1KMT2AHTTALDH1A1TP53
SCHEMBL13746191 0.79 TP53 (0.68) MEN1KMT2AGAAP2RX7EPHX2
SCHEMBL5476543 0.79 MEN1 (0.56) MEN1KMT2AGAAHTTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030096019-A1 Methods of using norfluoxetine SEPRACOR INC. 2003-05-22 US claimed
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
US-20070078188-A1 Compositions comprising and methods of using norfluoxetine CURRIE MARK G 2007-04-05 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 (3 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-20030096019-A1 Methods of using norfluoxetine NGF, TPH2, ALOX5 MEN1 3784/4885KMT2A 2911/4885NPC1 2133/4885
US-20070249618-A1 Novel Piperidine Derivatives as Histamine H3 Receptor Ligands for Treatment of Depression HRH3, HRH1, HRH4 MEN1 3623/4885KMT2A 323/4885NPC1 3750/4885
US-20070078188-A1 Compositions comprising and methods of using norfluoxetine ALOX5, NGF, PTGER4 MEN1 3553/4885KMT2A 3402/4885NPC1 1884/4885

“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.