SCHEMBL3237285

SCHEMBL3237285

Cc1n[nH]c2c(NCc3ccco3)ncnc12

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCNB2 O95067 2/20 0.61
CDK1 P06493 2/20 0.61
CCNB1 P14635 2/20 0.61
CCNB3 Q8WWL7 2/20 0.61
SMN1; SMN2 Q16637 9/20 0.60
TSHR P16473 5/20 0.60
KMT2A Q03164 4/20 0.60
MEN1 O00255 3/20 0.60
ALOX15 P16050 2/20 0.60
HIF1A Q16665 2/20 0.60
CYP1A2 P05177 2/20 0.60
TP53 P04637 1/20 0.60
ADORA3 P0DMS8 1/20 0.60
KDR P35968 1/20 0.60
HTT P42858 6/20 0.59
MAPK1 P28482 5/20 0.59
LMNA P02545 5/20 0.59
POLB P06746 4/20 0.59
ALDH1A1 P00352 4/20 0.59
MAPT P10636 4/20 0.59

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
SCHEMBL3239140 0.85 CCNB2 (0.68) CCNB2CDK1CCNB1CCNB3SMN1; SMN2
SCHEMBL3237278 0.81 CCNB2 (0.72) CCNB2CDK1CCNB1CCNB3SMN1; SMN2
SCHEMBL20120017 0.76 SMN1; SMN2 (0.65) CCNB2CDK1CCNB1CCNB3SMN1; SMN2
SCHEMBL3239134 0.76 CCNB2 (1.00) CCNB2CDK1CCNB1CCNB3SMN1; SMN2
Kinetin SCHEMBL29453466 0.75 SMN1; SMN2 (1.00) SMN1; SMN2TSHRKMT2AMEN1ALOX15
Kinetin SCHEMBL15706 0.75 SMN1; SMN2 (1.00) SMN1; SMN2TSHRKMT2AMEN1ALOX15
SCHEMBL11110949 0.75 SMN1; SMN2 (0.59) CCNB2CDK1CCNB1CCNB3SMN1; SMN2
Kinetin SCHEMBL584401 0.74 SMN1; SMN2 (0.97) SMN1; SMN2TSHRKMT2AMEN1ALOX15
SCHEMBL3774970 0.73 MEN1 (0.60) CCNB2CDK1CCNB1CCNB3SMN1; SMN2
SCHEMBL17009464 0.73 CCNB2 (0.56) CCNB2CDK1CCNB1CCNB3SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1475094-B1 Pyrazolo[4,3-D]pyrimidines, process for their preparation and methods of use USTAV EX BOTAN AKADEMIE VED CE (CZ) 2010-07-28 EP disclosed
US-20070167466-A1 \"Pyrazolo [4,3-d]pyrimidines, processes for their preparation and methods of use\ UNIVERZITA PALACKEHO V OLOMOUCI (CZ) 2007-07-19 US disclosed
WO-2004098608-A1 PYRAZOLO [4, 3-D]PYRIMIDINES, PROCESSES FOR THEIR PREPARATION AND METHODS OF USE ÚSTAV EXPERIMENTALNI BOTANIKY AKADEMIE VED CESKE REPUBLIKY (CZ) 2004-11-18 WO disclosed
EP-1475094-A1 Pyrazolo[4,3-D]pyrimidines, process for their preparation and methods of use Ustav Experimentalni Botaniky Akademie ved Ceské Republiky (CZ) 2004-11-10 EP 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-20070167466-A1 \"Pyrazolo [4,3-d]pyrimidines, processes for their preparation and methods of use\ CBR3, PYM1, PNPO CCNB2 1222/4885CDK1 1025/4885CCNB1 731/4885

“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.