SCHEMBL901132

SCHEMBL901132

COC(=O)NN=C(C)C(C)C(=O)OC

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.47
HPGD P15428 1/20 0.47
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
PKM P14618 2/20 0.37
SMN1; SMN2 Q16637 4/20 0.36
HTT P42858 2/20 0.36
MAPT P10636 2/20 0.36
KDM4E B2RXH2 1/20 0.36
GAA P10253 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
CA2 P00918 1/20 0.36
LMNA P02545 2/20 0.32
CA14 Q9ULX7 2/20 0.32
CA12 O43570 1/20 0.31

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
SCHEMBL901130 1.00 ALDH1A1 (0.47) ALDH1A1HPGDMEN1KMT2APKM
SCHEMBL204110 0.71
SCHEMBL23930808 0.71 PKM (0.33) ALDH1A1MEN1KMT2APKMSMN1; SMN2
SCHEMBL275280 0.69 SMN1; SMN2 (0.52) ALDH1A1KMT2ASMN1; SMN2CA2CA14
SCHEMBL16659207 0.69 LMNA (0.39) ALDH1A1HPGDMEN1KMT2APKM
SCHEMBL27513476 0.69
SCHEMBL858078 0.68
SCHEMBL18867261 0.68
SCHEMBL26658220 0.67 SMN1; SMN2 (0.50) ALDH1A1KMT2ASMN1; SMN2CA2CA14
SCHEMBL10805452 0.67 SMN1; SMN2 (0.50) ALDH1A1KMT2ASMN1; SMN2CA2CA14

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 3 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
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 441/4885HPGD 670/4885MEN1 4669/4885

“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.