SCHEMBL30808773

SCHEMBL30808773

CS(=O)(=O)c1ncc(C#N)c(-c2cnn(CC(F)F)c2)n1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCNT1 O60563 4/20 0.40
CDK1 P06493 4/20 0.40
CDK4 P11802 4/20 0.40
CCNB1 P14635 4/20 0.40
CCND1 P24385 4/20 0.40
CCNE1 P24864 4/20 0.40
CDK2 P24941 4/20 0.40
CCND3 P30281 4/20 0.40
CDK7 P50613 4/20 0.40
CDK9 P50750 4/20 0.40
CCNH P51946 4/20 0.40
MNAT1 P51948 4/20 0.40
CDK6 Q00534 4/20 0.40
KDM5A P29375 4/20 0.40
KDM5B Q9UGL1 3/20 0.40
MAP3K14 Q99558 1/20 0.36
IRAK4 Q9NWZ3 2/20 0.35
TTK P33981 1/20 0.34
KCNJ5 P48544 1/20 0.33
PIK3CD O00329 1/20 0.33

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
SCHEMBL30291202 0.81 CDK1 (0.58) CCNT1CDK1CDK4CCNB1CCND1
SCHEMBL31732415 0.80 KDM5A (0.39) CCNT1CDK1CDK4CCNB1CCND1
SCHEMBL29232088 0.70 JAK2 (0.58) CCNE1CDK2KDM5A
SCHEMBL30291173 0.67 CCNE1 (0.47) CCNT1CDK1CDK4CCNB1CCND1
SCHEMBL20987206 0.67 CDK4 (0.59) CDK1CDK4CCND1CDK2CCND3
SCHEMBL30810371 0.67 CCNE1 (0.59) CCNT1CDK1CDK4CCNB1CCND1
SCHEMBL16010754 0.66 TP53 (0.38) CCNT1CDK1CCNB1CDK2CDK7
SCHEMBL1817312 0.64 CSNK1A1 (0.51)
SCHEMBL3554942 0.64 CSNK1A1 (0.40)
SCHEMBL29314874 0.64 CDK1 (0.56) CCNT1CDK1CDK4CCNB1CCND1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250353842-A1 BICYCLIC AMINE CDK12 INHIBITORS INCYTE CORP (US) 2025-11-20 US disclosed
WO-2023250430-A1 BICYCLIC AMINE CDK12 INHIBITORS INCYTE CORPORATION (US) 2023-12-28 WO 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-20250353842-A1 BICYCLIC AMINE CDK12 INHIBITORS CDK12, CDK1, CDK2 CCNT1 60/4885CDK1 2/4885CDK4 35/4885

“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.