SCHEMBL901731

SCHEMBL901731

CCN1CCN(C(=O)c2cnn3c(O)c(Cc4cccc(C)c4)c(C)nc23)CC1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 13/20 0.62
KDM4E B2RXH2 13/20 0.62
HPGD P15428 11/20 0.62
LMNA P02545 4/20 0.62
MEN1 O00255 4/20 0.62
KMT2A Q03164 4/20 0.62
MAPT P10636 3/20 0.62
NPSR1 Q6W5P4 2/20 0.62
HSD17B10 Q99714 8/20 0.53
TSHR P16473 6/20 0.53
HTT P42858 3/20 0.52
USP2 O75604 4/20 0.51
MAPK1 P28482 2/20 0.51
RUVBL1 Q9Y265 3/20 0.49
POLB P06746 1/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
SMN1; SMN2 Q16637 3/20 0.48
TP53 P04637 1/20 0.48
ALOX12 P18054 1/20 0.48
CYP1A2 P05177 1/20 0.48

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
SCHEMBL902339 0.79 ALDH1A1 (0.67) ALDH1A1KDM4EHPGDLMNAMEN1
SCHEMBL15274740 0.77 ALDH1A1 (0.71) ALDH1A1KDM4EHPGDLMNAMEN1
SCHEMBL902537 0.76 ALDH1A1 (0.72) ALDH1A1KDM4EHPGDLMNAMEN1
SCHEMBL902549 0.75 ALDH1A1 (0.71) ALDH1A1KDM4EHPGDLMNAMEN1
SCHEMBL902831 0.75 ALDH1A1 (0.83) ALDH1A1KDM4EHPGDLMNAMEN1
SCHEMBL4782331 0.75 HSD17B10 (0.74) ALDH1A1KDM4EHPGDLMNAMEN1
SCHEMBL15261476 0.74 KDM4E (0.60) ALDH1A1KDM4EHPGDLMNAMEN1
SCHEMBL15262396 0.74 HSD17B10 (0.66) ALDH1A1KDM4EHPGDLMNAMEN1
SCHEMBL902315 0.74 KDM4E (0.84) ALDH1A1KDM4EHPGDLMNAMEN1
SCHEMBL902518 0.72 KDM4E (0.65) ALDH1A1KDM4EHPGDLMNAMEN1

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 6 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 claimed
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 claimed
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 claimed
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 4265/4885HPGD 670/4885

“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.