SCHEMBL165252

SCHEMBL165252

O=C(C1CC1)N1CCc2nc(OC3CCC(C4CCC4)CC3)sc2CC1

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 10/20 0.41
DRD3 P35462 4/20 0.36
HPGD P15428 1/20 0.35
DRD2 P14416 3/20 0.35
BRD4 O60885 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
GPR6 P46095 2/20 0.33
RORC P51449 1/20 0.33
DHODH Q02127 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
Cadaverine Tartrate SCHEMBL175333 0.93 GRM5 (0.39) GRM5DRD3DRD2GPR6
SCHEMBL17156974 0.82 GRM5 (0.39) GRM5DRD3DRD2GPR6
Cadaverine Tartrate SCHEMBL15736937 0.80 HRH3 (0.40) GRM5DRD3GPR6
SCHEMBL17156967 0.79 HRH3 (0.42) GRM5BRD4
SCHEMBL17156963 0.79 GRM5 (0.48) GRM5GPR6
Cadaverine Tartrate SCHEMBL164450 0.77 GRM5 (0.38) GRM5DRD3DRD2GPR6
SCHEMBL17156951 0.76 GRM5 (0.51) GRM5HDAC6
SCHEMBL17156958 0.76 GRM5 (0.51) GRM5HDAC6
SCHEMBL17156972 0.76 GRM5 (0.49) GRM5GPR6
SCHEMBL17156955 0.76 GRM5 (0.50) GRM5HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2611444-B1 HETEROCYCLYL COMPOUNDS AS HISTAMINE H3 RECEPTOR LIGANDS SUVEN LIFE SCIENCES LTD (IN) 2015-10-14 EP claimed
EP-2611444-B1 HETEROCYCLYL COMPOUNDS AS HISTAMINE H3 RECEPTOR LIGANDS SUVEN LIFE SCIENCES LTD (IN) 2015-10-14 EP disclosed
US-8912179-B2 Heterocyclyl compounds as histamine H3 receptor ligands SUVEN LIFE SCIENCES LIMITED (IN) 2014-12-16 US disclosed
US-20140148440-A1 HETEROCYCLYL COMPOUNDS AS HISTAMINE H3 RECEPTOR LIGANDS SUVEN LIFE SCIENCES LIMITED (IN) 2014-05-29 US disclosed
EP-2611444-A1 HETEROCYCLYL COMPOUNDS AS HISTAMINE H3 RECEPTOR LIGANDS Suven Life Sciences Limited (IN) 2013-07-10 EP disclosed
WO-2012029070-A1 HETEROCYCLYL COMPOUNDS AS HISTAMINE H3 RECEPTOR LIGANDS SUVEN LIFE SCIENCES LIMITED (IN) 2012-03-08 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 (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-20140148440-A1 HETEROCYCLYL COMPOUNDS AS HISTAMINE H3 RECEPTOR LIGANDS HRH3, HRH4, HRH1 GRM5 171/4885DRD3 695/4885HPGD 323/4885

“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.