SCHEMBL6209612

SCHEMBL6209612

NC(=O)c1c(C(F)(F)F)nn(-c2c(Cl)cc(Cl)cc2Cl)c1N

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 2/20 0.57
KDR P35968 2/20 0.57
GABRP O00591 12/20 0.49
GABRD O14764 12/20 0.49
GABRA1 P14867 12/20 0.49
GABRB1 P18505 12/20 0.49
GABRG2 P18507 12/20 0.49
GABRB3 P28472 12/20 0.49
GABRA5 P31644 12/20 0.49
GABRA3 P34903 12/20 0.49
GABRA2 P47869 12/20 0.49
GABRB2 P47870 12/20 0.49
GABRA4 P48169 12/20 0.49
GABRE P78334 12/20 0.49
GABRA6 Q16445 12/20 0.49
GABRG1 Q8N1C3 12/20 0.49
GABRG3 Q99928 12/20 0.49
GABRQ Q9UN88 12/20 0.49
L3MBTL1 Q9Y468 1/20 0.47
RIPK2 O43353 4/20 0.45

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
SCHEMBL7707193 0.91 GABRP (0.60) SRCKDRGABRPGABRDGABRA1
SCHEMBL10482885 0.82 GABRP (0.64) SRCKDRGABRPGABRDGABRA1
SCHEMBL7713174 0.80 GABRA2 (0.70) SRCKDRGABRPGABRDGABRA1
SCHEMBL6208684 0.78 SRC (0.57) SRCKDRGABRPGABRDGABRA1
SCHEMBL10581666 0.77 GABRA2 (0.54) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL10571672 0.76 GABRB3 (0.50) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL7965709 0.76 SRC (0.58) SRCKDRGABRPGABRDGABRA1
SCHEMBL7707477 0.76 GABRP (0.74) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL7967756 0.76 GABRP (0.61) SRCKDRGABRPGABRDGABRA1
SCHEMBL6208048 0.76 KDR (0.57) SRCKDRGABRPGABRDGABRA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1383769-A4 6-SUBSTITUTED PYRAZOLO 3,4-D]PYRIMIDIN-4-ONES USEFUL AS CYCLIN DEPENDENT KINASE INHIBITORS BRISTOL MYERS SQUIBB PHARMA CO (US) 2005-08-03 EP disclosed
EP-1121363-B1 6-SUBSTITUTED PYRAZOLO(3,4-d)PYRIMIDIN-4-ONES USEFUL AS CYCLIN DEPENDENT KINASE INHIBITORS BRISTOL MYERS SQUIBB PHARMA CO (US) 2004-12-22 EP disclosed
EP-1383769-A2 6-SUBSTITUTED PYRAZOLO 3,4-D]PYRIMIDIN-4-ONES USEFUL AS CYCLIN DEPENDENT KINASE INHIBITORS Bristol-Myers Squibb Pharma Company (US) 2004-01-28 EP disclosed
US-6559152-B2 For therapy of cancer or other proliferative diseases DUPONT PHARMACEUTICALS COMPANY 2003-05-06 US disclosed
US-6531477-B1 Treating cancer or other proliferative diseases DUPONT PHARMACEUTICALS COMPANY 2003-03-11 US disclosed
WO-2002067654-A3 6-SUBSTITUTED PYRAZOLO[3,4-D]PYRIMIDIN-4-ONES USEFUL AS CYCLIN DEPENDENT KINASE INHIBITORS BRISTOL MYERS SQUIBB PHARMA CO (US) 2002-10-31 WO disclosed
WO-2002067654-A2 6-SUBSTITUTED PYRAZOLO[3,4-D]PYRIMIDIN-4-ONES USEFUL AS CYCLIN DEPENDENT KINASE INHIBITORS BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2002-09-06 WO disclosed
US-20020013328-A1 6-Substituted pyrazolo[3,4-d] pyrimidin-4-ones useful as cyclin dependent kinase inhibitors BRISTOL-MYERS SQUIBB PHARMA COMPANY 2002-01-31 US disclosed
EP-1121363-A2 6-SUBSTITUTED PYRAZOLO 3,4-d]PYRIMIDIN-4-ONES USEFUL AS CYCLIN DEPENDENT KINASE INHIBITORS Du Pont Pharmaceuticals Company (US) 2001-08-08 EP disclosed
WO-2000021926-A2 6-SUBSTITUTED PYRAZOLO[3,4-d]PYRIMIDIN-4-ONES USEFUL AS CYCLIN DEPENDENT KINASE INHIBITORS DU PONT PHARMACEUTICALS COMPANY (US) 2000-04-20 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-20020013328-A1 6-Substituted pyrazolo[3,4-d] pyrimidin-4-ones useful as cyclin dependent kinase inhibitors CCNK, CCNI, CDK1 SRC 1160/4885KDR 2834/4885GABRP 3370/4885

“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.