SCHEMBL3219630

SCHEMBL3219630

CCc1cn(C(N)=O)c2cnccc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM5A P29375 2/20 0.42
ELANE P08246 2/20 0.40
SLC6A2 P23975 1/20 0.39
DYRK1A Q13627 4/20 0.39
NFATC1 O95644 3/20 0.39
GSK3B P49841 3/20 0.39
KCNH2 Q12809 1/20 0.37
SCN9A Q15858 2/20 0.36
SIRT3 Q9NTG7 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
CNR1 P21554 1/20 0.36
CNR2 P34972 1/20 0.36
CCNC P24863 2/20 0.34
CDK8 P49336 2/20 0.34
CYP2E1 P05181 1/20 0.34
CYP2C8 P10632 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2A6 P11509 1/20 0.34
CYP2B6 P20813 1/20 0.34
CYP2C19 P33261 1/20 0.34

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
SCHEMBL3216495 0.83 SCN9A (0.38) KDM5AELANEDYRK1ANFATC1GSK3B
SCHEMBL3226537 0.83 SCN9A (0.40) KDM5AELANEDYRK1ANFATC1GSK3B
SCHEMBL3216732 0.81 SIRT3 (0.45) KDM5AELANESLC6A2DYRK1ANFATC1
SCHEMBL3218054 0.78 DYRK1A (0.41) KDM5AELANEDYRK1ANFATC1GSK3B
SCHEMBL3219635 0.78 KDM5A (0.42) KDM5ASLC6A2DYRK1ANFATC1GSK3B
SCHEMBL3231704 0.75 ELANE (0.39) KDM5AELANEDYRK1ANFATC1GSK3B
SCHEMBL3210094 0.75 ELANE (0.39) ELANEDYRK1ANFATC1GSK3BSCN9A
SCHEMBL28691109 0.74 SCN9A (0.44) KDM5AELANEDYRK1ANFATC1GSK3B
Trifluoroacetic Acid SCHEMBL3232865 0.73 KDM5A (0.40) KDM5AELANESLC6A2SCN9ACNR1
SCHEMBL29228860 0.73 ELANE (0.43) KDM5AELANEDYRK1ANFATC1GSK3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2142516-B1 PYRIMIDINE HYDRAZIDE COMPOUNDS AS PGDS INHIBITORS SANOFI SA (FR) 2012-12-26 EP claimed
US-8258130-B2 Pyrimidine hydrazide compounds as PGDS inhibitors SANOFI (FR) 2012-09-04 US claimed
US-20100048568-A1 PYRIMIDINE HYDRAZIDE COMPOUNDS AS PGDS INHIBITORS SANOFI-AVENTIS (FR) 2010-02-25 US claimed
EP-2142516-A1 PYRIMIDINE HYDRAZIDE COMPOUNDS AS PGDS INHIBITORS Sanofi-Aventis (FR) 2010-01-13 EP claimed
WO-2008121670-A1 PYRIMIDINE HYDRAZIDE COMPOUNDS AS PGDS INHIBITORS SANOFI-AVENTIS (FR) 2008-10-09 WO claimed
EP-2142516-B1 PYRIMIDINE HYDRAZIDE COMPOUNDS AS PGDS INHIBITORS SANOFI SA (FR) 2012-12-26 EP 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
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 KDM5A 1903/4885ELANE 2436/4885SLC6A2 4643/4885

“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.