SCHEMBL1528093

SCHEMBL1528093

COc1cccc(Nc2cc(NCC3CC3)n3ncc(C=C4CC(=O)NC4=O)c3n2)c1Cl

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CSNK2B P67870 1/20 0.50
TYK2 P29597 11/20 0.36
STAT3 P40763 1/20 0.36
GRM2 Q14416 1/20 0.34
CDK1 P06493 1/20 0.34
CCNE1 P24864 1/20 0.34
CDK2 P24941 1/20 0.34
CDK7 P50613 1/20 0.34
CCNH P51946 1/20 0.34
MNAT1 P51948 1/20 0.34
PDE4D Q08499 1/20 0.33
P2RX7 Q99572 1/20 0.33
TTK P33981 1/20 0.32
MEN1 O00255 1/20 0.32
MAPT P10636 1/20 0.32
KMT2A Q03164 1/20 0.32
PIM1 P11309 1/20 0.32
PIM2 Q9P1W9 1/20 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
SCHEMBL12768865 1.00 CSNK2B (0.50) CSNK2BTYK2STAT3GRM2CDK1
SCHEMBL1527970 0.90 CSNK2B (0.53) CSNK2BTYK2STAT3PDE4DMEN1
SCHEMBL1527969 0.90 CSNK2B (0.53) CSNK2BTYK2STAT3PDE4DMEN1
SCHEMBL12830240 0.87 CSNK2B (0.49) CSNK2BTYK2STAT3P2RX7MEN1
SCHEMBL1527860 0.87 CSNK2B (0.50) CSNK2BTYK2STAT3CDK1CCNE1
SCHEMBL12769153 0.87 CSNK2B (0.50) CSNK2BTYK2STAT3GRM2P2RX7
SCHEMBL12768845 0.87 CSNK2B (0.50) CSNK2BTYK2STAT3CDK1CCNE1
SCHEMBL12841429 0.85 CSNK2B (0.47) CSNK2BTYK2CDK1CCNE1CDK2
SCHEMBL1527901 0.84 CSNK2B (0.60) CSNK2BTYK2CDK1CCNE1CDK2
SCHEMBL12768852 0.84 CSNK2B (0.60) CSNK2BTYK2CDK1CCNE1CDK2

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 17/4885TYK2 39/4885STAT3 515/4885

“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.