SCHEMBL2028832

SCHEMBL2028832

CS(=O)(=O)NCc1cccc(Nc2cc(-c3ccccc3OC(F)(F)F)ncn2)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK9 P50750 19/20 0.58
CCNT1 O60563 18/20 0.58
MAP4K4 O95819 2/20 0.58
CDK1 P06493 2/20 0.58
CDK4 P11802 2/20 0.58
CCNB1 P14635 2/20 0.58
CCND1 P24385 2/20 0.58
ABL2 P42684 2/20 0.58
GSK3A P49840 2/20 0.58
CDK7 P50613 2/20 0.58
CCNH P51946 2/20 0.58
MNAT1 P51948 2/20 0.58
CCNA2 P20248 1/20 0.58
CDK2 P24941 1/20 0.58
CCNA1 P78396 1/20 0.58
CDK5 Q00535 1/20 0.58
CDK5R1 Q15078 1/20 0.58
LMNA P02545 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47

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
SCHEMBL2026640 0.89 CDK9 (0.74) CDK9CCNT1MAP4K4CDK1CDK4
SCHEMBL2025346 0.88 CCNT1 (0.63) CDK9CCNT1MAP4K4CDK1CDK4
SCHEMBL2024692 0.87 CDK9 (0.66) CDK9CCNT1MAP4K4CDK1CDK4
SCHEMBL2024088 0.86 CDK9 (0.64) CDK9CCNT1MAP4K4CDK1CDK4
SCHEMBL2029828 0.86 CDK9 (0.62) CDK9CCNT1MAP4K4CDK1CDK4
SCHEMBL2048010 0.86 CDK9 (0.62) CDK9CCNT1MAP4K4CDK1CDK4
SCHEMBL2024632 0.86 CYP1A2 (0.56) CDK9CCNT1MAP4K4CDK1CDK4
SCHEMBL2028939 0.85 CDK9 (0.59) CDK9CCNT1MAP4K4CDK1CDK4
SCHEMBL2028758 0.85 ABL1 (0.49) CDK9CCNT1MAP4K4CDK1CDK4
SCHEMBL2026511 0.84 CDK9 (0.54) CDK9CCNT1MAP4K4CDK1CDK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2516405-B1 4-PHENYLAMINO-PYRIMIDINE DERIVATIVES HAVING PROTEIN KINASE INHIBITOR ACTIVITY VIROSTATICS S R L (IT) 2015-09-30 EP disclosed
US-9040529-B2 4-phenylamino-pyrimidine derivatives having protein kinase inhibitor activity VICHEM CHEMIE KUTATÓ KFT. (HU) 2015-05-26 US disclosed
EP-2516405-A1 4-PHENYLAMINO-PYRIMIDINE DERIVATIVES HAVING PROTEIN KINASE INHIBITOR ACTIVITY Vichem Chemie Kutató KFT (HU) 2012-10-31 EP disclosed
US-20120258968-A1 4-PHENYLAMINO-PYRIMIDINE DERIVATIVES HAVING PROTEIN KINASE INHIBITOR ACTIVITY VIROSTATICS S.R.L. (IT) 2012-10-11 US disclosed
WO-2011077171-A1 4-PHENYLAMINO-PYRIMIDINE DERIVATIVES HAVING PROTEIN KINASE INHIBITOR ACTIVITY VICHEM CHEMIE KUTATÓ KFT. (HU) 2011-06-30 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-20120258968-A1 4-PHENYLAMINO-PYRIMIDINE DERIVATIVES HAVING PROTEIN KINASE INHIBITOR ACTIVITY CDK9, CDK19, CDKL3 CDK9 1/4885CCNT1 47/4885MAP4K4 135/4885

“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.