SCHEMBL8515150

SCHEMBL8515150

O=C(O)N1CCC(Oc2ccnc(Cl)n2)CC1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 5/20 0.41
CCNK O75909 2/20 0.40
CDK12 Q9NYV4 2/20 0.40
GPR119 Q8TDV5 1/20 0.39
CYP2C9 P11712 2/20 0.38
CYP2C19 P33261 1/20 0.38
CYP2J2 P51589 1/20 0.38
SCD O00767 1/20 0.38
KMO O15229 1/20 0.37
JAK3 P52333 2/20 0.36
ALDH1A1 P00352 1/20 0.36
HTT P42858 1/20 0.36

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
SCHEMBL26987481 0.92 SPR (0.40) EPHX2CCNKCDK12GPR119CYP2C9
SCHEMBL14121158 0.92 SPR (0.40) EPHX2CCNKCDK12GPR119CYP2C9
SCHEMBL27130047 0.92 SPR (0.40) EPHX2CCNKCDK12GPR119CYP2C9
SCHEMBL30757104 0.92 SPR (0.40) EPHX2CCNKCDK12GPR119CYP2C9
SCHEMBL1066440 0.82 GPR119 (0.56) GPR119
SCHEMBL1982754 0.82 GPR119 (0.55) GPR119
SCHEMBL5267332 0.82 MALT1 (0.45) EPHX2CCNKCDK12CYP2C9CYP2J2
SCHEMBL5267084 0.81 EPHX2 (0.41) EPHX2CYP2C9CYP2J2
SCHEMBL25307709 0.80 DGAT1 (0.44) KMO
SCHEMBL25307708 0.80 DGAT1 (0.44) KMO

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2863916-B1 SUBSTITUTED PYRIDINE SPLEEN TYROSINE KINASE (SYK) INHIBITORS MERCK SHARP & DOHME (US) 2018-07-18 EP disclosed
EP-2884982-B1 SUBSTITUTED PHENYL SPLEEN TYROSINE KINASE (Syk) INHIBITORS MERCK SHARP & DOHME (US) 2017-09-20 EP disclosed
US-9376418-B2 Substituted pyridine spleen tyrosine kinase (SYK) inhibitors MERCK SHARP & DOHME CORP. (US) 2016-06-28 US disclosed
US-9353066-B2 Substituted phenyl-Spleen Tyrosine Kinase (Syk) inhibitors MERCK SHARP & DOHME CORP. (US) 2016-05-31 US disclosed
US-20150232428-A1 SUBSTITUTED PHENYL-SPLEEN TYROSINE KINASE (SYK) INHIBITORS MERCK CANADA INC. (CA) 2015-08-20 US disclosed
US-20150148327-A1 SUBSTITUTED PYRIDINE SPLEEN TYROSINE KINASE (SYK) INHIBITORS MERCK CANADA INC. (CA) 2015-05-28 US disclosed
WO-2012069852-A1 PHARMACEUTICAL COMPOUNDS AS INHIBITORS OF SPHINGOSINE KINASE ALMAC DISCOVERY LIMITED (GB) 2012-05-31 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-20150232428-A1 SUBSTITUTED PHENYL-SPLEEN TYROSINE KINASE (SYK) INHIBITORS SYK, BTK, LYN EPHX2 2513/4885CCNK 725/4885CDK12 1655/4885
US-20150148327-A1 SUBSTITUTED PYRIDINE SPLEEN TYROSINE KINASE (SYK) INHIBITORS SYK, BTK, LYN EPHX2 2487/4885CCNK 568/4885CDK12 1277/4885

“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.