SCHEMBL10138390

SCHEMBL10138390

CC(O)COc1ccc(-c2cncc3ccc(C(N)=O)nc23)cc1

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CCNC P24863 14/20 0.56
CDK8 P49336 14/20 0.56
SLC22A12 Q96S37 2/20 0.39
LMNA P02545 1/20 0.37
APP P05067 1/20 0.36
KDM1A O60341 1/20 0.36
FYN P06241 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
SCHEMBL578607 0.85 CCNC (0.59) CCNCCDK8LMNA
SCHEMBL10138383 0.85 CCNC (0.54) CCNCCDK8SLC22A12LMNAAPP
SCHEMBL15742721 0.84 CCNC (0.61) CCNCCDK8SLC22A12
SCHEMBL10138392 0.83 CCNC (0.57) CCNCCDK8SLC22A12APP
SCHEMBL15742774 0.82 CCNC (0.65) CCNCCDK8APP
SCHEMBL15743020 0.81 CCNC (0.55) CCNCCDK8
SCHEMBL10128543 0.81 CCNC (0.55) CCNCCDK8
SCHEMBL10138393 0.81 CCNC (0.54) CCNCCDK8APPFYN
SCHEMBL578632 0.80 CCNC (0.54) CCNCCDK8LMNAAPP
SCHEMBL10138535 0.80 CCNC (0.54) CCNCCDK8SLC22A12

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 2959/4885SLC22A12 1300/4885

“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.