SCHEMBL7243148

SCHEMBL7243148

CCCNc1sc(C(N)=O)c2c1-c1c(cnn1C)CC2

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CCNC P24863 14/20 0.62
CDK8 P49336 14/20 0.62
CDK19 Q9BWU1 14/20 0.62
DRD2 P14416 3/20 0.44
DRD4 P21917 3/20 0.44
CDK9 P50750 2/20 0.38
CCNA2 P20248 2/20 0.36
CDK2 P24941 2/20 0.36
CCNA1 P78396 2/20 0.36
AURKA O14965 1/20 0.36
IKBKB O14920 1/20 0.36
MAP3K19 Q56UN5 1/20 0.35
HIPK1 Q86Z02 1/20 0.35
HASPIN Q8TF76 1/20 0.35
DYRK1B Q9Y463 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
SCHEMBL7249156 0.87 CCNC (0.46) CCNCCDK8CDK19DRD2DRD4
SCHEMBL7248593 0.80 CCNC (0.61) CCNCCDK8CDK19DRD2DRD4
SCHEMBL7249277 0.80 CCNC (0.63) CCNCCDK8CDK19DRD2DRD4
SCHEMBL7241539 0.79 CCNC (0.72) CCNCCDK8CDK19DRD2DRD4
SCHEMBL15105154 0.79 CCNC (0.64) CCNCCDK8CDK19DRD2DRD4
SCHEMBL7096849 0.79 CCNC (0.74) CCNCCDK8CDK19DRD2DRD4
SCHEMBL7249264 0.78 CCNC (0.66) CCNCCDK8CDK19DRD2DRD4
SCHEMBL7243137 0.78 CCNC (0.61) CCNCCDK8CDK19DRD2DRD4
SCHEMBL7246966 0.78 CCNC (0.61) CCNCCDK8CDK19DRD2DRD4
Hydrochloric Acid SCHEMBL7241413 0.78 CCNC (0.73) CCNCCDK8CDK19DRD2DRD4

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
EP-2617726-A1 DIABETES THERAPEUTIC AGENT Takeda Pharmaceutical Company Limited (JP) 2013-07-24 EP disclosed
US-20130184272-A1 DIABETES THERAPEUTIC AGENT TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2013-07-18 US disclosed
US-20030158245-A1 Fused heterocyclic derivatives, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2003-08-21 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 (2 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-20130184272-A1 DIABETES THERAPEUTIC AGENT FABP4, GPR119, CPT1B CCNC 3196/4885CDK8 4502/4885CDK19 4521/4885
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.