SCHEMBL9927211

SCHEMBL9927211

CSc1nc(NCc2ccc(Br)cc2)n2ncc(C(C)C)c2n1

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 19/20 0.50
CDK5 Q00535 3/20 0.50
CDK5R1 Q15078 3/20 0.50
CDK9 P50750 18/20 0.48
CDK7 P50613 2/20 0.48
CCNT1 O60563 1/20 0.48
CCNA2 P20248 1/20 0.48
CCNE1 P24864 1/20 0.48
CCNH P51946 1/20 0.48
CDK4 P11802 1/20 0.44

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
SCHEMBL10324747 0.87 CDK2 (0.54) CDK2CDK5CDK5R1CDK9CDK7
SCHEMBL7886130 0.83 USP1 (0.51) CDK2CDK5CDK5R1CDK9CDK7
SCHEMBL10323982 0.83 CDK2 (0.45) CDK2CDK5CDK5R1CDK9CDK7
SCHEMBL7895863 0.82 CDK2 (0.65) CDK2CDK5CDK5R1CDK9CDK7
SCHEMBL29842280 0.82 CDK2 (0.51) CDK2CDK5CDK5R1CDK9CDK7
SCHEMBL18073030 0.82 CDK2 (0.51) CDK2CDK5CDK5R1CDK9CDK7
SCHEMBL7883742 0.81 CDK2 (0.51) CDK2CDK5CDK5R1CDK9CDK7
SCHEMBL19912776 0.79 CDK2 (0.54) CDK2CDK9CDK7CDK4
SCHEMBL6895325 0.77 SRC (0.47) CDK2
SCHEMBL18050975 0.77 CDK2 (0.45) CDK2CDK5CDK5R1CDK9CDK7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8691982-B2 Pyrazolo[1,5-a]-1,3,5-triazine derivatives, preparation thereof, and therapeutic use thereof CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2014-04-08 US disclosed
US-8691982-B2 Pyrazolo[1,5-a]-1,3,5-triazine derivatives, preparation thereof, and therapeutic use thereof CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2014-04-08 US disclosed
EP-2406263-B1 PYRAZOLO[1,5-A]-1,3,5-TRIAZINE DERIVATIVES, PREPARATION THEREOF, AND THERAPEUTIC USE THEREOF CENTRE NAT RECH SCIENT (FR) 2013-09-25 EP disclosed
EP-2406263-B1 PYRAZOLO[1,5-A]-1,3,5-TRIAZINE DERIVATIVES, PREPARATION THEREOF, AND THERAPEUTIC USE THEREOF CENTRE NAT RECH SCIENT (FR) 2013-09-25 EP disclosed
US-20120184557-A1 PYRAZOLO[1,5-A]-1,3,5-TRIAZINE DERIVATIVES, PREPARATION THEREOF, AND THERAPEUTIC USE THEREOF CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2012-07-19 US disclosed
US-20120184557-A1 PYRAZOLO[1,5-A]-1,3,5-TRIAZINE DERIVATIVES, PREPARATION THEREOF, AND THERAPEUTIC USE THEREOF CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2012-07-19 US disclosed
US-20120184557-A1 PYRAZOLO[1,5-A]-1,3,5-TRIAZINE DERIVATIVES, PREPARATION THEREOF, AND THERAPEUTIC USE THEREOF CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2012-07-19 US disclosed
US-20120149708-A1 MODULATORS OF VIRAL TRANSCRIPTION, AND METHODS AND COMPOSITIONS THEREWITH GEORGE MASON UNIVERSITY 2012-06-14 US disclosed
US-20120149708-A1 MODULATORS OF VIRAL TRANSCRIPTION, AND METHODS AND COMPOSITIONS THEREWITH GEORGE MASON UNIVERSITY 2012-06-14 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 (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-20120149708-A1 MODULATORS OF VIRAL TRANSCRIPTION, AND METHODS AND COMPOSITIONS THEREWITH CDK2, CCNA1, CDK1 CDK2 1/4885CDK5 23/4885CDK5R1 36/4885
US-20120184557-A1 PYRAZOLO[1,5-A]-1,3,5-TRIAZINE DERIVATIVES, PREPARATION THEREOF, AND THERAPEUTIC USE THEREOF AOC3, CBR3, RTN3 CDK2 1344/4885CDK5 1491/4885CDK5R1 916/4885

“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.