SCHEMBL7248663

SCHEMBL7248663

CSc1sc(C(N)=O)c2c1-c1oncc1CCC2

nearest known ligand 0.86

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CCNC P24863 16/20 0.86
CDK8 P49336 16/20 0.86
CDK19 Q9BWU1 16/20 0.86
CDK9 P50750 1/20 0.55
KDM4E B2RXH2 2/20 0.45
ALDH1A1 P00352 1/20 0.45
POLB P06746 1/20 0.45
RXFP1 Q9HBX9 1/20 0.45
GAA P10253 1/20 0.41
HTT P42858 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40

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
SCHEMBL7447024 0.81 CCNC (0.78) CCNCCDK8CDK19CDK9KDM4E
SCHEMBL6978646 0.75 CCNC (0.59) CCNCCDK8CDK19CDK9KDM4E
SCHEMBL6976237 0.71 CCNC (0.55) CCNCCDK8CDK19CDK9KDM4E
SCHEMBL6978882 0.71 CCNC (0.55) CCNCCDK8CDK19CDK9GAA
SCHEMBL18429198 0.71 CCNC (1.00) CCNCCDK8CDK19CDK9
SCHEMBL6990670 0.71 CCNC (0.60) CCNCCDK8CDK19CDK9KDM4E
SCHEMBL6967359 0.70 CCNC (0.56) CCNCCDK8CDK19CDK9KDM4E
SCHEMBL7241443 0.70 CCNC (1.00) CCNCCDK8CDK19CDK9
SCHEMBL6977569 0.70 CCNC (0.53) CCNCCDK8CDK19CDK9ALDH1A1
SCHEMBL6980131 0.69 CCNC (0.55) CCNCCDK8CDK19CDK9KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030158245-A1 Fused heterocyclic derivatives, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2003-08-21 US claimed
US-20030158245-A1 Fused heterocyclic derivatives, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2003-08-21 US disclosed
JP-2000239280-A TRICYCLIC THIOPHENE COMPOUND TAISHO PHARMACEUT CO LTD 2000-09-05 JP 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-20030158245-A1 Fused heterocyclic derivatives, their production and use TST, STS, AHR CCNC 2012/4885CDK8 3614/4885CDK19 2184/4885

“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.