SCHEMBL4636115

SCHEMBL4636115

CCOC(=O)C(=NOC)c1csc(NC(=O)c2cnc(-c3ccccc3)nc2)n1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.55
RAB9A P51151 4/20 0.55
NPC1 O15118 3/20 0.55
MAPT P10636 8/20 0.50
MEN1 O00255 6/20 0.50
KMT2A Q03164 6/20 0.50
NPSR1 Q6W5P4 4/20 0.50
GAA P10253 3/20 0.50
TDP1 Q9NUW8 3/20 0.50
RECQL P46063 1/20 0.50
MAPK1 P28482 2/20 0.48
HSP90AA1 P07900 2/20 0.48
LMNA P02545 3/20 0.47
CRHBP P24387 1/20 0.47
CRHR2 Q13324 1/20 0.47
HPGD P15428 3/20 0.46
HTT P42858 1/20 0.46
HSD17B10 Q99714 1/20 0.46
KDM4E B2RXH2 3/20 0.44
ALDH1A1 P00352 2/20 0.44

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
SCHEMBL4636113 1.00 SMN1; SMN2 (0.55) SMN1; SMN2RAB9ANPC1MAPTMEN1
SCHEMBL10989739 0.80 MAPT (0.52) SMN1; SMN2RAB9ANPC1MAPTMEN1
SCHEMBL10922951 0.80 MAPT (0.52) SMN1; SMN2RAB9ANPC1MAPTMEN1
SCHEMBL28022501 0.79 MAPT (0.53) SMN1; SMN2RAB9ANPC1MAPTMEN1
SCHEMBL28022500 0.79 MAPT (0.53) SMN1; SMN2RAB9ANPC1MAPTMEN1
SCHEMBL9659812 0.79 MAPT (0.51) SMN1; SMN2RAB9ANPC1MAPTMEN1
SCHEMBL9659817 0.79 MAPT (0.51) SMN1; SMN2RAB9ANPC1MAPTMEN1
SCHEMBL10924083 0.79 MAPT (0.51) SMN1; SMN2RAB9ANPC1MAPTMEN1
SCHEMBL10923462 0.78 CYP1A2 (0.55) SMN1; SMN2RAB9ANPC1MAPTMEN1
SCHEMBL9344703 0.77 MAPT (0.55) SMN1; SMN2RAB9ANPC1MAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8202863-B2 2-Phenyl-pyrimidine-5-carboxylic acid benzylamide; to treat allergic and/or inflammatory disorders, particularly disorders such as allergic rhinitis, asthma and/or chronic obstructive pulmonary disease AVENTIS PHARMACEUTICALS INC. (US) 2012-06-19 US claimed
US-20080227782-A1 PYRIMIDINE AMIDE COMPOUNDS AS PGDS INHIBITORS AVENTIS PHARMACEUTICALS INC (US) 2008-09-18 US claimed
EP-1937652-A1 PYRIMIDINE AMIDE COMPOUNDS AS PGDS INHIBITORS Aventis Pharmaceuticals Inc. (US) 2008-07-02 EP claimed
WO-2007041634-A1 PYRIMIDINE AMIDE COMPOUNDS AS PGDS INHIBITORS AVENTIS PHARMACEUTICALS INC. (US) 2007-04-12 WO claimed
EP-1937652-B1 PYRIMIDINE AMIDE COMPOUNDS AS PGDS INHIBITORS AVENTIS PHARMA INC (US) 2014-07-30 EP disclosed
US-8202863-B2 2-Phenyl-pyrimidine-5-carboxylic acid benzylamide; to treat allergic and/or inflammatory disorders, particularly disorders such as allergic rhinitis, asthma and/or chronic obstructive pulmonary disease AVENTIS PHARMACEUTICALS INC. (US) 2012-06-19 US disclosed
US-20080227782-A1 PYRIMIDINE AMIDE COMPOUNDS AS PGDS INHIBITORS AVENTIS PHARMACEUTICALS INC (US) 2008-09-18 US disclosed
EP-1937652-A1 PYRIMIDINE AMIDE COMPOUNDS AS PGDS INHIBITORS Aventis Pharmaceuticals Inc. (US) 2008-07-02 EP disclosed
WO-2007041634-A1 PYRIMIDINE AMIDE COMPOUNDS AS PGDS INHIBITORS AVENTIS PHARMACEUTICALS INC. (US) 2007-04-12 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-20080227782-A1 PYRIMIDINE AMIDE COMPOUNDS AS PGDS INHIBITORS HRH2, HRH1, LTC4S SMN1; SMN2 4671/4885RAB9A 2462/4885NPC1 1707/4885

“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.