SCHEMBL3220165

SCHEMBL3220165

Fc1ccc2[nH]cc(CCc3cccnc3)c2c1

nearest known ligand 0.69

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MPO P05164 11/20 0.56
HTR2A P28223 3/20 0.56
TRPM8 Q7Z2W7 1/20 0.56
HTR1A P08908 1/20 0.55
KMT2A Q03164 1/20 0.55
GPR84 Q9NQS5 2/20 0.54
SLC6A4 P31645 3/20 0.53

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
SCHEMBL5725721 0.88 GPR84 (0.63) MPOHTR2ATRPM8HTR1AKMT2A
SCHEMBL11050443 0.83 MPO (0.61) MPOHTR2ATRPM8HTR1AKMT2A
SCHEMBL6168855 0.82 MEN1 (0.56) MPOHTR2ATRPM8KMT2AGPR84
SCHEMBL27614638 0.78 MPO (0.58) MPOHTR2AHTR1ASLC6A4
SCHEMBL14297179 0.77 SPR (0.64) HTR2AHTR1AKMT2ASLC6A4
SCHEMBL5947112 0.77 MPO (0.56) MPOHTR2AHTR1AKMT2ASLC6A4
SCHEMBL7091759 0.76 KIF20A (0.50) HTR2AGPR84
SCHEMBL5724971 0.73 GPR84 (0.71) MPOHTR2ATRPM8HTR1AKMT2A
SCHEMBL5726248 0.72 TDO2 (0.79) HTR1A
SCHEMBL517983 0.72 MPO (0.73) MPOHTR2ATRPM8HTR1AKMT2A

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
CN-101646656-B Pyrimidine hydrazide compounds as PGDS inhibitors SANOFI AVENTIS SPA 2013-08-14 CN disclosed
US-8258130-B2 Pyrimidine hydrazide compounds as PGDS inhibitors SANOFI (FR) 2012-09-04 US disclosed
US-20100048568-A1 PYRIMIDINE HYDRAZIDE COMPOUNDS AS PGDS INHIBITORS SANOFI-AVENTIS (FR) 2010-02-25 US disclosed
CN-101646656-A Pyrimidine hydrazide compounds as the PGDS inhibitor SANOFI AVENTIS FR 2010-02-10 CN disclosed
EP-2142516-A1 PYRIMIDINE HYDRAZIDE COMPOUNDS AS PGDS INHIBITORS Sanofi-Aventis (FR) 2010-01-13 EP disclosed
WO-2008121670-A1 PYRIMIDINE HYDRAZIDE COMPOUNDS AS PGDS INHIBITORS SANOFI-AVENTIS (FR) 2008-10-09 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-20100048568-A1 PYRIMIDINE HYDRAZIDE COMPOUNDS AS PGDS INHIBITORS HRH2, HRH1, HRH4 MPO 885/4885HTR2A 1005/4885TRPM8 1847/4885

“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.