SCHEMBL12841018

SCHEMBL12841018

Cc1ccc(F)c(Nc2cc(NCC3CC3)n3ncc(/C=C4\CC(O)NC4=O)c3n2)c1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CSNK2B P67870 1/20 0.44
CSNK2A2 P19784 3/20 0.37
TTK P33981 8/20 0.35
CYP3A4 P08684 2/20 0.35
KCNH2 Q12809 2/20 0.34
CDK1 P06493 1/20 0.33
CCNE1 P24864 1/20 0.33
CDK2 P24941 1/20 0.33
CDK7 P50613 1/20 0.33
CCNH P51946 1/20 0.33
MNAT1 P51948 1/20 0.33
TYK2 P29597 5/20 0.32

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
SCHEMBL12841165 0.87 CSNK2B (0.44) CSNK2BCSNK2A2TTKCYP3A4KCNH2
SCHEMBL1528130 0.87 CSNK2B (0.60) CSNK2BCSNK2A2TTKCYP3A4KCNH2
SCHEMBL1528131 0.87 CSNK2B (0.60) CSNK2BCSNK2A2TTKCYP3A4KCNH2
SCHEMBL12841181 0.87 CSNK2A2 (0.37) CSNK2BCSNK2A2TTKCYP3A4CDK1
SCHEMBL12841182 0.81 CSNK2A2 (0.36) CSNK2BCSNK2A2TTKCYP3A4CDK1
SCHEMBL12841297 0.80 CSNK2B (0.41) CSNK2BCSNK2A2KCNH2CDK2TYK2
SCHEMBL12841403 0.80 CNR2 (0.39) CSNK2BCSNK2A2
SCHEMBL12841421 0.80 CSNK2A2 (0.46) CSNK2BCSNK2A2KCNH2TYK2
SCHEMBL12841290 0.80 TTK (0.45) CSNK2BTTKCYP3A4CDK2
SCHEMBL12841287 0.79 CSNK2B (0.32) CSNK2BTTKCYP3A4CDK1CCNE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110071115-A1 PHARMACEUTICALLY USEFUL HETEROCYCLE-SUBSTITUTED LACTAMS CYLENE PHARMACEUTICALS, INC. (US) 2011-03-24 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-20110071115-A1 PHARMACEUTICALLY USEFUL HETEROCYCLE-SUBSTITUTED LACTAMS PIM2, PIM1, PIM3 CSNK2B 17/4885CSNK2A2 9/4885TTK 178/4885

“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.