SCHEMBL20286068

SCHEMBL20286068

C=CC(=C)Nc1cccc(Nc2cc(N[C@H]3CC[C@H](N(C)C)CC3)nc3c(CC)cnn23)c1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ CDK2 P24941 9/20 0.50
▸ CSNK2A1 P68400 3/20 0.50
▸ CCNT1 O60563 1/20 0.50
▸ CCNK O75909 1/20 0.50
▸ CCNE1 P24864 1/20 0.50
▸ CDK7 P50613 1/20 0.50
▸ CDK9 P50750 1/20 0.50
▸ CCNH P51946 1/20 0.50
▸ MNAT1 P51948 1/20 0.50
▸ CDK13 Q14004 1/20 0.50
▸ CDK12 Q9NYV4 1/20 0.50
▸ CSNK2A2 P19784 10/20 0.47
▸ CSNK2B P67870 1/20 0.47
▸ GSK3B P49841 6/20 0.41
▸ HIPK1 Q86Z02 1/20 0.39
▸ DYRK2 Q92630 1/20 0.39
▸ HIPK2 Q9H2X6 1/20 0.39
▸ HIPK3 Q9H422 1/20 0.39
▸ STK17A Q9UEE5 1/20 0.39

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
SCHEMBL18313115 0.93 CDK2 (0.58) CDK2CSNK2A1CCNT1CCNKCCNE1
SCHEMBL20549662 0.93 CDK2 (0.58) CDK2CSNK2A1CCNT1CCNKCCNE1
SCHEMBL21472931 0.89 CSNK2A1 (0.63) CDK2CSNK2A1CCNT1CCNKCCNE1
SCHEMBL20549702 0.87 CDK2 (0.53) CDK2CSNK2A1CCNT1CCNKCCNE1
SCHEMBL18313497 0.87 CDK2 (0.53) CDK2CSNK2A1CCNT1CCNKCCNE1
SCHEMBL23609246 0.87 CDK2 (0.47) CDK2CSNK2A1CCNT1CCNKCCNE1
SCHEMBL20286069 0.87 CDK2 (0.53) CDK2CSNK2A1CDK7CDK9CCNH
SCHEMBL20549734 0.86 CDK2 (0.48) CDK2CSNK2A1CSNK2A2CSNK2BGSK3B
SCHEMBL20549736 0.86 CDK2 (0.48) CDK2CSNK2A1CSNK2A2CSNK2BGSK3B
SCHEMBL20286071 0.85 CSNK2A1 (0.61) CDK2CSNK2A1CCNT1CCNKCCNE1

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-20180169097-A1 COMBINATION THERAPY OF TRANSCRIPTION INHIBITORS AND KINASE INHIBITORS DANA-FARBER CANCER INSTITUTE, INC. (US) 2018-06-21 — — 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 (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-20180169097-A1 COMBINATION THERAPY OF TRANSCRIPTION INHIBITORS AND KINASE INHIBITORS CHUK, BCOR, MYC CDK2 63/4885CSNK2A1 145/4885CCNT1 440/4885

“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.

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