SCHEMBL10138546

SCHEMBL10138546

NC(=O)c1ccc2cncc(-c3ccc(OCCOc4ccc(C(=O)O)cn4)cc3)c2n1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CCNC P24863 10/20 0.48
CDK8 P49336 10/20 0.48
MAPT P10636 1/20 0.39
CHEK2 O96017 3/20 0.38
PARP10 Q53GL7 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
SLC22A12 Q96S37 1/20 0.37
PKM P14618 1/20 0.36
RARB P10826 1/20 0.35
FYN P06241 1/20 0.35

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
SCHEMBL10138535 0.92 CCNC (0.54) CCNCCDK8CHEK2PARP10SLC22A12
SCHEMBL13091680 0.89 CCNC (0.47) CCNCCDK8MAPTCHEK2L3MBTL1
SCHEMBL10138589 0.86 CCNC (0.48) CCNCCDK8CHEK2SLC22A12RARB
SCHEMBL578607 0.84 CCNC (0.59) CCNCCDK8CHEK2
SCHEMBL10127743 0.83 CCNC (0.43) CCNCCDK8CHEK2PARP10SLC22A12
SCHEMBL10138543 0.83 CCNC (0.53) CCNCCDK8MAPTCHEK2L3MBTL1
Hydrochloric Acid SCHEMBL585959 0.82 CCNC (0.43) CCNCCDK8CHEK2PKMRARB
SCHEMBL10128543 0.82 CCNC (0.55) CCNCCDK8MAPTCHEK2L3MBTL1
SCHEMBL10138405 0.82 CCNC (0.53) CCNCCDK8CHEK2
SCHEMBL10138588 0.82 CCNC (0.50) CCNCCDK8CHEK2FYN

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 2959/4885MAPT 4571/4885

“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.