SCHEMBL902640

SCHEMBL902640

COC(=O)c1nc2ccnn2c(O)c1Cc1cccc(F)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.52
KDM4E B2RXH2 3/20 0.52
L3MBTL1 Q9Y468 2/20 0.52
HPGD P15428 2/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
HSD17B10 Q99714 2/20 0.52
MAPK1 P28482 1/20 0.52
PLA2G2A P14555 2/20 0.43
HSP90AA1 P07900 1/20 0.40
HSP90B1 P14625 1/20 0.40
MAPT P10636 1/20 0.40
ENPP1 P22413 1/20 0.38
MRGPRX4 Q96LA9 1/20 0.38
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
GAA P10253 1/20 0.37
RECQL P46063 1/20 0.37
POLB P06746 2/20 0.37
TP53 P04637 1/20 0.37
HCAR2 Q8TDS4 1/20 0.37

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
SCHEMBL902261 0.90 PDE4A (0.49) ALDH1A1KDM4EL3MBTL1HPGDSMN1; SMN2
SCHEMBL902616 0.88 KCNN3 (0.46) ALDH1A1KDM4EL3MBTL1HPGDSMN1; SMN2
SCHEMBL901635 0.88 KDM4E (0.43) ALDH1A1KDM4EL3MBTL1HPGDSMN1; SMN2
SCHEMBL902011 0.87 HCAR2 (0.44) ALDH1A1KDM4EL3MBTL1HPGDSMN1; SMN2
SCHEMBL902320 0.87 L3MBTL1 (0.43) ALDH1A1KDM4EL3MBTL1HPGDSMN1; SMN2
SCHEMBL15274730 0.85 PDE4D (0.46) ALDH1A1KDM4EL3MBTL1HPGDSMN1; SMN2
SCHEMBL902478 0.83 TSHR (0.39) ALDH1A1KDM4EL3MBTL1HPGDSMN1; SMN2
SCHEMBL902369 0.81 PDE4B (0.40) ALDH1A1PLA2G2AHSP90AA1HSP90B1MAPT
SCHEMBL15274729 0.80 PDE4A (0.50) ALDH1A1KDM4EL3MBTL1HPGDSMN1; SMN2
SCHEMBL902942 0.79 ENPP1 (0.41) ALDH1A1KDM4EL3MBTL1HPGDSMN1; 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130252951-A1 7-HYDROXY-PYRAZOLO[1,5-A] PYRIMIDINE COMPOUNDS AND THEIR USE AS CCR2 RECEPTOR ANTAGONISTS PROXIMAGEN LIMITED (GB) 2013-09-26 US disclosed
US-20130252951-A1 7-HYDROXY-PYRAZOLO[1,5-A] PYRIMIDINE COMPOUNDS AND THEIR USE AS CCR2 RECEPTOR ANTAGONISTS PROXIMAGEN LIMITED (GB) 2013-09-26 US disclosed
US-20130252951-A1 7-HYDROXY-PYRAZOLO[1,5-A] PYRIMIDINE COMPOUNDS AND THEIR USE AS CCR2 RECEPTOR ANTAGONISTS PROXIMAGEN LIMITED (GB) 2013-09-26 US disclosed
EP-2621928-A1 7-HYDROXY-PYRAZOLO[1,5-A]PYRIMIDINE COMPOUNDS AND THEIR USE AS CCR2 RECEPTOR ANTAGONISTS Proximagen Limited (GB) 2013-08-07 EP disclosed
WO-2012041817-A1 7-HYDROXY-PYRAZOLO[1,5-A] PYRIMIDINE COMPOUNDS AND THEIR USE AS CCR2 RECEPTOR ANTAGONISTS PROXIMAGEN LTD (GB) 2012-04-05 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-20130252951-A1 7-HYDROXY-PYRAZOLO[1,5-A] PYRIMIDINE COMPOUNDS AND THEIR USE AS CCR2 RECEPTOR ANTAGONISTS CCR2, CCR5, CCR1 ALDH1A1 441/4885KDM4E 4265/4885L3MBTL1 3226/4885

“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.