SCHEMBL14752146

SCHEMBL14752146

COC(C/N=C(\Nc1ccc(Cl)cc1)c1c(-c2cc(Cl)ccc2Cl)nc2cccnn12)OC

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 16/20 0.37
PDE4D Q08499 16/20 0.37
PDE4A P27815 10/20 0.36
PDE4C Q08493 10/20 0.36
MAPK13 O15264 3/20 0.36
MAPK12 P53778 3/20 0.36
MAPK11 Q15759 3/20 0.36
MAPK14 Q16539 3/20 0.36
CYP3A4 P08684 1/20 0.34
CYP2C19 P33261 1/20 0.34

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
SCHEMBL14752213 0.84 SMN1; SMN2 (0.45)
SCHEMBL14740112 0.84 SMN1; SMN2 (0.45)
SCHEMBL14740111 0.84 SMN1; SMN2 (0.45)
SCHEMBL14752145 0.78 SMN1; SMN2 (0.46)
SCHEMBL14739475 0.73 PDE4A (0.51) PDE4BPDE4DPDE4APDE4CCYP2C19
SCHEMBL14740467 0.72 PDE4B (0.46) PDE4BPDE4DPDE4APDE4CMAPK13
SCHEMBL14740113 0.68 DPP4 (0.38)
SCHEMBL14740346 0.66 SMN1; SMN2 (0.49) CYP3A4
SCHEMBL14740345 0.66 SMN1; SMN2 (0.49) CYP3A4
SCHEMBL14740076 0.64 LMNA (0.43) PDE4BPDE4DPDE4APDE4CCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9593109-B2 Bicyclic agonists of GPR131 and uses thereof CYMABAY THERAPEUTICS, INC. (US) 2017-03-14 US disclosed
US-9593109-B2 Bicyclic agonists of GPR131 and uses thereof CYMABAY THERAPEUTICS, INC. (US) 2017-03-14 US disclosed
US-20130059845-A1 BICYCLIC AGONISTS OF GPR131 AND USES THEREOF METABOLEX, INC. 2013-03-07 US disclosed
US-20130059845-A1 BICYCLIC AGONISTS OF GPR131 AND USES THEREOF METABOLEX, INC. 2013-03-07 US disclosed
WO-2013032939-A1 BICYCLIC AGONISTS OF GPR131 AND USES THEREOF METABOLEX, INC. (US) 2013-03-07 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-20130059845-A1 BICYCLIC AGONISTS OF GPR131 AND USES THEREOF GPR119, GPR88, GPR3 PDE4B 358/4885PDE4D 284/4885PDE4A 274/4885

“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.