SCHEMBL932075

SCHEMBL932075

CC(C)(C(=O)c1ccc(OCCCCl)cc1)N1CCOCC1

nearest known ligand 0.66

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 7/20 0.66
ALDH1A1 P00352 4/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
TSHR P16473 1/20 0.56
MAPK1 P28482 1/20 0.56
POLB P06746 2/20 0.50
RAB9A P51151 1/20 0.50
THRB P10828 2/20 0.49
LMNA P02545 1/20 0.49
MAPT P10636 1/20 0.49
KMT2A Q03164 1/20 0.49
GAA P10253 2/20 0.49
KDM4E B2RXH2 1/20 0.48
THRA P10827 1/20 0.47
USP2 O75604 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 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
SCHEMBL10456891 0.93 HRH3 (0.70) HRH3ALDH1A1SMN1; SMN2TSHRMAPK1
SCHEMBL10456895 0.92 HRH3 (0.68) HRH3ALDH1A1SMN1; SMN2TSHRMAPK1
SCHEMBL8176206 0.90 HRH3 (0.66) HRH3ALDH1A1SMN1; SMN2TSHRMAPK1
SCHEMBL8182732 0.89 HRH3 (0.65) HRH3ALDH1A1SMN1; SMN2TSHRMAPK1
SCHEMBL8175825 0.89 HRH3 (0.65) HRH3ALDH1A1SMN1; SMN2TSHRMAPK1
SCHEMBL18883163 0.88 HRH3 (0.59) HRH3ALDH1A1SMN1; SMN2TSHRMAPK1
SCHEMBL727286 0.88 HRH3 (0.64) HRH3ALDH1A1SMN1; SMN2TSHRMAPK1
SCHEMBL28731828 0.87 HRH3 (0.63) HRH3ALDH1A1SMN1; SMN2TSHRMAPK1
SCHEMBL10458536 0.87 ALDH1A1 (0.62) HRH3ALDH1A1SMN1; SMN2TSHRMAPK1
SCHEMBL10458541 0.82 ALDH1A1 (0.67) HRH3ALDH1A1SMN1; SMN2TSHRMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140296212-A1 SUBSTITUTED PHENOXYPROPYLCYCLOAMINE DERIVATIVES AS HISTAMINE-3 (H3) RECEPTOR LIGANDS CEPHALON, INC. (US) 2014-10-02 US disclosed
US-20140296212-A1 SUBSTITUTED PHENOXYPROPYLCYCLOAMINE DERIVATIVES AS HISTAMINE-3 (H3) RECEPTOR LIGANDS CEPHALON, INC. (US) 2014-10-02 US disclosed
US-8648067-B2 Substituted phenoxypropylcycloamine derivatives as histamine-3 (H3) receptor ligands CEPHALON, INC. (US) 2014-02-11 US disclosed
US-8648067-B2 Substituted phenoxypropylcycloamine derivatives as histamine-3 (H3) receptor ligands CEPHALON, INC. (US) 2014-02-11 US disclosed
US-20120238551-A1 Substituted Phenoxypropylcycloamine Derivatives as Histamine-3 (H3) Receptor Ligands CEPHALON FRANCE (FR) 2012-09-20 US disclosed
US-20120238551-A1 Substituted Phenoxypropylcycloamine Derivatives as Histamine-3 (H3) Receptor Ligands CEPHALON FRANCE (FR) 2012-09-20 US disclosed
EP-2459529-A1 SUBSTITUTED PHENOXYPROPYLCYCLOAMINE DERIVATIVES AS HISTAMINE-3 (H3) RECEPTOR LIGANDS Cephalon, Inc. (US) 2012-06-06 EP disclosed
WO-2011002984-A1 SUBSTITUTED PHENOXYPROPYLCYCLOAMINE DERIVATIVES AS HISTAMINE-3 (H3) RECEPTOR LIGANDS CEPHALON, INC. (US) 2011-01-06 WO disclosed
WO-2011002984-A1 SUBSTITUTED PHENOXYPROPYLCYCLOAMINE DERIVATIVES AS HISTAMINE-3 (H3) RECEPTOR LIGANDS CEPHALON, INC. (US) 2011-01-06 WO 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-20140296212-A1 SUBSTITUTED PHENOXYPROPYLCYCLOAMINE DERIVATIVES AS HISTAMINE-3 (H3) RECEPTOR LIGANDS HRH3, HRH4, HRH2 HRH3 1/4885ALDH1A1 2032/4885SMN1; SMN2 4805/4885
US-20120238551-A1 Substituted Phenoxypropylcycloamine Derivatives as Histamine-3 (H3) Receptor Ligands HRH3, HRH4, HRH2 HRH3 1/4885ALDH1A1 2032/4885SMN1; SMN2 4805/4885

“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.