SCHEMBL2881842

SCHEMBL2881842

NC(=O)c1ccc(Nc2nc(-c3ccc(-c4ccc(F)cc4)cc3)cc3ccnn23)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAK O14976 1/20 0.46
PDGFRB P09619 1/20 0.46
KIT P10721 1/20 0.46
FLT3 P36888 1/20 0.46
MKNK2 Q9HBH9 1/20 0.46
MARK1 Q9P0L2 1/20 0.46
STK17A Q9UEE5 1/20 0.46
CCNE1 P24864 1/20 0.42
CDK2 P24941 1/20 0.42
ALOX5 P09917 1/20 0.41
CALCA P06881 1/20 0.40
GPR119 Q8TDV5 1/20 0.40
JAK2 O60674 1/20 0.40
MAPK8 P45983 2/20 0.40
MAPK10 P53779 1/20 0.40
KDM4E B2RXH2 2/20 0.39
ALDH1A1 P00352 2/20 0.39
HPGD P15428 2/20 0.39
MAPK1 P28482 1/20 0.39
HSD17B10 Q99714 1/20 0.39

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
SCHEMBL2879548 0.88 KDR (0.43) GAKPDGFRBKITFLT3MKNK2
SCHEMBL2214207 0.85 CALCA (0.46) CCNE1CDK2ALOX5CALCAGPR119
SCHEMBL2215297 0.84 PTPN1 (0.45) ALDH1A1MAPK1
SCHEMBL2881428 0.83 FYN (0.51) CCNE1CDK2MAPK8MAPK10KDM4E
SCHEMBL2876730 0.83 PLAU (0.52) MKNK2CCNE1CDK2MAPK8GSK3B
SCHEMBL2213844 0.82 PTPN1 (0.43) PDGFRBKITKDM4EALDH1A1MAPK1
SCHEMBL2881793 0.82 CSNK2A1 (0.46) CCNE1CDK2MAPK8MAPK10KDM4E
SCHEMBL2213436 0.80 CYP17A1 (0.43)
SCHEMBL2214363 0.77 HDAC1 (0.42) KITALDH1A1
SCHEMBL2213856 0.77 MELK (0.48) GSK3B

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-7745446-B2 Pyrazolo[1,5-c]pyrimidines BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-06-29 US disclosed
US-20070254046-A1 Novel Pyrazolopyrimidines ALTANA PHARMA AG (DE) 2007-11-01 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 (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-20070254046-A1 Novel Pyrazolopyrimidines MCL1, RARS2, CDK4 GAK 903/4885PDGFRB 2385/4885KIT 716/4885

“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.