SCHEMBL384595

SCHEMBL384595

OCC1CCN(c2ncc(F)cn2)CC1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 1/20 0.46
MAPK10 P53779 1/20 0.46
SIGMAR1 Q99720 6/20 0.45
PDE10A Q9Y233 3/20 0.43
RIPK1 Q13546 2/20 0.43
ADORA2A P29274 1/20 0.42
KDM4E B2RXH2 1/20 0.42
CYP1A2 P05177 1/20 0.42
GAA P10253 1/20 0.42
CYP2C9 P11712 1/20 0.42
DRD2 P14416 1/20 0.42

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
SCHEMBL20893475 0.83 PDE10A (0.48) MAPK8MAPK10PDE10A
SCHEMBL11360192 0.83 PDE10A (0.48) MAPK8MAPK10PDE10A
SCHEMBL26122808 0.82 CHRM2 (0.46) MAPK8MAPK10KDM4E
SCHEMBL13622628 0.81 FFAR4 (0.47) RIPK1ADORA2A
SCHEMBL460460 0.80 KDM4E (0.56) MAPK8MAPK10PDE10AKDM4EGAA
SCHEMBL3929507 0.80 RIPK1 (0.46) SIGMAR1RIPK1KDM4ECYP1A2GAA
SCHEMBL23327807 0.80 MAPK8 (0.44) MAPK8MAPK10PDE10AKDM4E
SCHEMBL14622839 0.80 ADORA2A (0.43) SIGMAR1RIPK1ADORA2ADRD2
SCHEMBL1103982 0.80 MAPK8 (0.47) MAPK8MAPK10PDE10AKDM4E
SCHEMBL8208254 0.79 POLB (0.58) MAPK8MAPK10KDM4E

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
CN-101657471-B Bicyclic compounds and their use as antidiabetics SMITHKLINE BEECHAM CORP 2013-07-03 CN disclosed
US-20120077812-A1 BICYCLIC COMPOUNDS AND USE AS ANTIDIABETICS FANG JING (US) 2012-03-29 US disclosed
US-8101634-B2 Bicyclic compounds and use as antidiabetics GLAXOSMITHKLINE LLC (US) 2012-01-24 US disclosed
EP-2325182-A1 Bicyclic compounds and use as antidiabetics Glaxosmithkline LLC (US) 2011-05-25 EP disclosed
CN-101657471-A Bicyclic compounds and their use as antidiabetics SMITHKLINE BEECHAM CORP US 2010-02-24 CN disclosed
US-20100029650-A1 BICYCLIC COMPOUNDS AND USE AS ANTIDIABETICS SMITH KLINE BEECHAM CORPORATION a corporation 2010-02-04 US disclosed
EP-2094683-A2 BICYCLIC COMPOUNDS AND USE AS ANTIDIABETICS SmithKline Beecham Corporation (US) 2009-09-02 EP disclosed
WO-2008070692-A2 BICYCLIC COMPOUNDS AND USE AS ANTIDIABETICS SMITHKLINE BEECHAM CORPORATION (US) 2008-06-12 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-20120077812-A1 BICYCLIC COMPOUNDS AND USE AS ANTIDIABETICS GPR119, GOT2, PC MAPK8 1710/4885MAPK10 2532/4885SIGMAR1 3676/4885
US-20100029650-A1 BICYCLIC COMPOUNDS AND USE AS ANTIDIABETICS GPR119, GOT2, PC MAPK8 1710/4885MAPK10 2532/4885SIGMAR1 3676/4885

“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.