SCHEMBL10109668

SCHEMBL10109668

CC1CCC(N(C)c2ccccc2)CC1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
JAK1 P23458 1/20 0.40
JAK3 P52333 1/20 0.40
ACHE P22303 3/20 0.36
HRH1 P35367 1/20 0.36
TAAR1 Q96RJ0 1/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
HTT P42858 1/20 0.35
DRD2 P14416 1/20 0.35
DRD3 P35462 1/20 0.35
PKM P14618 1/20 0.34
KDM4E B2RXH2 2/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
ALDH1A1 P00352 1/20 0.33

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
SCHEMBL1720308 0.91 HTT (0.41) JAK3HRH1TAAR1MEN1KMT2A
Hydrochloric Acid SCHEMBL23292665 0.89 HTT (0.39) HRH1TAAR1MEN1KMT2AHTT
SCHEMBL28096957 0.85 MEN1 (0.44) JAK3HRH1MEN1KMT2AHTT
SCHEMBL17704661 0.83 ACHE (0.38) ACHETAAR1MEN1KMT2AHTT
SCHEMBL26191606 0.83 ACHE (0.38) ACHETAAR1MEN1KMT2AHTT
SCHEMBL11693073 0.83 ALDH1A1 (0.47) JAK3MEN1KMT2AHTTPKM
SCHEMBL182620 0.81 ALDH1A1 (0.50) JAK3MEN1KMT2APKMKDM4E
SCHEMBL20733138 0.81 ALDH1A1 (0.50) JAK3MEN1KMT2APKMKDM4E
SCHEMBL20733110 0.81 ALDH1A1 (0.50) JAK3MEN1KMT2APKMKDM4E
SCHEMBL19227318 0.81 ALDH1A1 (0.50) JAK3MEN1KMT2APKMKDM4E

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-20120074395-A1 ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO., LTD. (JP) 2012-03-29 US disclosed
EP-1773796-B1 OXOPIPERIDINE DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI AVENTIS (FR) 2010-03-03 EP disclosed
US-20070149562-A1 OXOPIPERIDINE DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2007-06-28 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-20070149562-A1 OXOPIPERIDINE DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF MC5R, MC4R, OPRD1 JAK1 875/4885JAK3 1190/4885ACHE 1330/4885

“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.