SCHEMBL10138447

SCHEMBL10138447

NC(=O)c1ccc2cncc(-c3ccc(OCCCOC4CCOCC4)c(F)c3)c2n1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CCNC P24863 9/20 0.41
CDK8 P49336 9/20 0.41
FFAR4 Q5NUL3 4/20 0.38
MAPK1 P28482 2/20 0.36
GRM2 Q14416 1/20 0.34
ALOX5AP P20292 1/20 0.34
FEN1 P39748 1/20 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

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
SCHEMBL10138424 0.96 CCNC (0.41) CCNCCDK8FFAR4MAPK1GRM2
SCHEMBL10138449 0.94 CCNC (0.40) CCNCCDK8FFAR4MAPK1GRM2
SCHEMBL10138499 0.88 CCNC (0.43) CCNCCDK8FFAR4GRM2PDE4A
SCHEMBL10138435 0.86 CCNC (0.41) CCNCCDK8MAPK1GRM2ALOX5AP
SCHEMBL10138415 0.84 CCNC (0.52) CCNCCDK8GRM2ALOX5APFEN1
SCHEMBL14823068 0.82 CCNC (0.41) CCNCCDK8FFAR4GRM2PDE4A
SCHEMBL10138476 0.81 CCNC (0.42) CCNCCDK8MAPK1ALOX5APFEN1
SCHEMBL578375 0.81 CCNC (0.48) CCNCCDK8CYP11B2
SCHEMBL10138453 0.81 CCNC (0.41) CCNCCDK8GRM2ALOX5APFEN1
SCHEMBL10138521 0.81 CCNC (0.41) CCNCCDK8GRM2PDE4APDE4B

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 4 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

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 2959/4885FFAR4 2423/4885

“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.