SCHEMBL310348

SCHEMBL310348

CCCN1CCC(c2ccc(N)c(OCC)c2)CC1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 11/20 0.54
SLC6A4 P31645 1/20 0.54
SIGMAR1 Q99720 1/20 0.47
KDM4E B2RXH2 1/20 0.45
MEN1 O00255 1/20 0.45
ALDH1A1 P00352 1/20 0.45
POLB P06746 1/20 0.45
MAPT P10636 1/20 0.45
HPGD P15428 1/20 0.45
MAPK1 P28482 1/20 0.45
KMT2A Q03164 1/20 0.45
HSD17B10 Q99714 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
HTR4 Q13639 1/20 0.45
DRD3 P35462 2/20 0.44

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
SCHEMBL310593 0.88 DRD2 (0.62) DRD2SLC6A4SIGMAR1HTR4
SCHEMBL310804 0.87 DRD2 (0.46) DRD2SLC6A4SIGMAR1KDM4EMEN1
SCHEMBL10257638 0.84 DRD2 (0.40) DRD2SLC6A4KDM4EMEN1ALDH1A1
SCHEMBL10290610 0.83 CCR5 (0.43) DRD2SLC6A4SIGMAR1KDM4EMEN1
SCHEMBL11303523 0.82 ALDH1A1 (0.45) DRD2SLC6A4KDM4EMEN1ALDH1A1
SCHEMBL13981570 0.80 DRD2 (0.62) DRD2SLC6A4SIGMAR1DRD3
SCHEMBL20725583 0.77 QDPR (0.49) DRD2SLC6A4ALDH1A1HTR4
SCHEMBL2927880 0.76 DRD2 (0.61) DRD2SLC6A4SIGMAR1DRD3
SCHEMBL519694 0.76 QDPR (0.52) DRD2SLC6A4HTR4
SCHEMBL310239 0.76 QDPR (0.49) DRD2SLC6A4HTR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2162454-B1 IMIDAZOPYRIDINE KINASE INHIBITORS GLAXOSMITHKLINE LLC (US) 2013-01-02 EP disclosed
US-8093239-B2 Imidazopyridine kinase inhibitors GLAXOSMITHKLINE LLC (US) 2012-01-10 US disclosed
US-20100216779-A1 Imidazopyridine Kinase Inhibitors GLAXOSMITHKLINE LLC 2010-08-26 US disclosed
US-20100216779-A1 Imidazopyridine Kinase Inhibitors GLAXOSMITHKLINE LLC 2010-08-26 US disclosed
US-20100216779-A1 Imidazopyridine Kinase Inhibitors GLAXOSMITHKLINE LLC 2010-08-26 US disclosed
EP-2162454-A1 IMIDAZOPYRIDINE KINASE INHIBITORS GlaxoSmithKline LLC (US) 2010-03-17 EP disclosed
WO-2008150799-A1 IMIDAZOPYRIDINE KINASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2008-12-11 WO disclosed
US-20080300242-A1 Imidazopyridine Kinase Inhibitors GLAXOSMITHKLINE LLC 2008-12-04 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 (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-20080300242-A1 Imidazopyridine Kinase Inhibitors ABL1, MAP3K19, MAP3K5 DRD2 4179/4885SLC6A4 3709/4885SIGMAR1 2251/4885
US-20100216779-A1 Imidazopyridine Kinase Inhibitors ABL1, MAP3K19, MAP3K5 DRD2 4179/4885SLC6A4 3709/4885SIGMAR1 2251/4885

“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.