SCHEMBL22113094

SCHEMBL22113094

c1cc(Nc2ncc3ccc4cnn(C5CCCC5)c4c3n2)ncc1N1CCNCC1

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CDK4 P11802 20/20 0.62
CCND1 P24385 16/20 0.62
CCND2 P30279 8/20 0.62
CCND3 P30281 8/20 0.62
CCNA2 P20248 6/20 0.62
CDK2 P24941 6/20 0.62
FGFR1 P11362 6/20 0.62
FGFR2 P21802 6/20 0.62
FGFR4 P22455 6/20 0.62
FGFR3 P22607 6/20 0.62
CCNA1 P78396 4/20 0.62
CDK6 Q00534 4/20 0.58
CDK1 P06493 1/20 0.57
CCNB1 P14635 1/20 0.57
FLT3 P36888 1/20 0.57

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
SCHEMBL22113090 0.96 CDK4 (0.61) CDK4CCND1CCND2CCND3CCNA2
SCHEMBL22112936 0.89 CDK4 (0.56) CDK4CCND1CCND2CCND3CCNA2
SCHEMBL23376091 0.89 CDK4 (0.52) CDK4CCND1CCND2CCND3CCNA2
SCHEMBL22965021 0.87 CDK4 (0.59) CDK4CCND1CCND2CCND3CCNA2
Hydrochloric Acid SCHEMBL29918502 0.86 CDK4 (0.58) CDK4CCND1CCND2CCND3CCNA2
SCHEMBL12639361 0.86 CDK4 (0.71) CDK4CCND1CCND2CCND3CCNA2
SCHEMBL23375908 0.86 CDK4 (0.56) CDK4CCND1CCND2CCND3CCNA2
SCHEMBL22113095 0.84 CDK4 (0.50) CDK4CCND1CCND2CCND3CCNA2
SCHEMBL21698797 0.84 CDK4 (0.60) CDK4CCND1CCND2CCND3CCNA2
SCHEMBL22112935 0.84 CDK4 (0.58) CDK4CCND1CCND2CCND3CCNA2

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-11319323-B2 Substituted pyrazolo[4,3-H]quinazolines as protein kinase inhibitors SHENGKE PHARMACEUTICALS (JIANGSU) LTD. (CN) 2022-05-03 US disclosed
US-20210147424-A1 1H-PYRAZOLO[4,3-H]QUINAZOLINE COMPOUND SERVING AS PROTEIN KINASE INHIBITOR SHENGKE PHARMACEUTICALS (JIANGSU) LTD. (CN) 2021-05-20 US disclosed
EP-3666774-A1 1H-PYRAZOLO[4,3-H]QUINAZOLINE COMPOUND SERVING AS PROTEIN KINASE INHIBITOR Shengke Pharmaceuticals (Jiangsu) Ltd. (CN) 2020-06-17 EP 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-20210147424-A1 1H-PYRAZOLO[4,3-H]QUINAZOLINE COMPOUND SERVING AS PROTEIN KINASE INHIBITOR CDK1, CDKL1, CDK2 CDK4 6/4885CCND1 33/4885CCND2 46/4885
US-11319323-B2 Substituted pyrazolo[4,3-H]quinazolines as protein kinase inhibitors CDK1, CDK2, CDK3 CDK4 8/4885CCND1 34/4885CCND2 55/4885

“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.