SCHEMBL10138424

SCHEMBL10138424

NC(=O)c1ccc2cncc(-c3ccc(OCCOC4CCOCC4)c(F)c3)c2n1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CCNC P24863 9/20 0.41
CDK8 P49336 9/20 0.41
MAPK1 P28482 2/20 0.37
FFAR4 Q5NUL3 2/20 0.36
GRM2 Q14416 1/20 0.34
ALOX5AP P20292 2/20 0.34
FEN1 P39748 2/20 0.34
KCNH2 Q12809 1/20 0.33
PDE4A P27815 1/20 0.33
PDE4B Q07343 1/20 0.33
PDE4C Q08493 1/20 0.33
PDE4D Q08499 1/20 0.33
CYP11B2 P19099 1/20 0.33
ABL1 P00519 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
SCHEMBL10138449 0.98 CCNC (0.40) CCNCCDK8MAPK1FFAR4GRM2
SCHEMBL10138447 0.96 CCNC (0.41) CCNCCDK8MAPK1FFAR4GRM2
SCHEMBL10138499 0.92 CCNC (0.43) CCNCCDK8FFAR4GRM2PDE4A
SCHEMBL10138435 0.90 CCNC (0.41) CCNCCDK8MAPK1GRM2ALOX5AP
SCHEMBL14823068 0.86 CCNC (0.41) CCNCCDK8FFAR4GRM2PDE4A
SCHEMBL578375 0.86 CCNC (0.48) CCNCCDK8CYP11B2ABL1
SCHEMBL10138476 0.85 CCNC (0.42) CCNCCDK8MAPK1ALOX5APFEN1
SCHEMBL10138432 0.85 CCNC (0.40) CCNCCDK8FFAR4GRM2ALOX5AP
SCHEMBL10138521 0.85 CCNC (0.41) CCNCCDK8GRM2PDE4APDE4B
SCHEMBL578454 0.84 L3MBTL1 (0.41) CCNCCDK8FFAR4GRM2PDE4A

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-8410273-B2 Cyclic compound having substituted phenyl group DAIICHI SANKYO COMPANY, LIMITED (JP) 2013-04-02 US disclosed
US-8410273-B2 Cyclic compound having substituted phenyl group DAIICHI SANKYO COMPANY, LIMITED (JP) 2013-04-02 US disclosed
US-20120040936-A1 CYCLIC COMPOUND HAVING SUBSTITUTED PHENYL GROUP DAIICHI SANKYO COMPANY, LIMITED (JP) 2012-02-16 US disclosed
US-20120040936-A1 CYCLIC COMPOUND HAVING SUBSTITUTED PHENYL GROUP DAIICHI SANKYO COMPANY, LIMITED (JP) 2012-02-16 US disclosed
WO-2010116915-A1 CYCLIC COMPOUND HAVING SUBSTITUTED PHENYL GROUP 第一三共株式会社 (JP) 2010-10-14 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-20120040936-A1 CYCLIC COMPOUND HAVING SUBSTITUTED PHENYL GROUP BMP2, BMP4, BMP6 CCNC 1592/4885CDK8 2959/4885MAPK1 998/4885

“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.