SCHEMBL3224320

SCHEMBL3224320

CCOC(=O)c1cnc(-c2ccccn2)nc1C

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.55
ALDH1A1 P00352 6/20 0.54
SMN1; SMN2 Q16637 4/20 0.54
MAPT P10636 4/20 0.54
MAPK1 P28482 1/20 0.54
ATM Q13315 1/20 0.54
RAB9A P51151 5/20 0.54
NPSR1 Q6W5P4 1/20 0.54
NPC1 O15118 5/20 0.53
TP53 P04637 2/20 0.53
L3MBTL1 Q9Y468 3/20 0.53
KDM4E B2RXH2 2/20 0.53
CYP1A2 P05177 1/20 0.50
POLB P06746 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
GAA P10253 1/20 0.49
HTT P42858 1/20 0.49
MEN1 O00255 1/20 0.48
KMT2A Q03164 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
SCHEMBL12929474 0.85 LMNA (0.51) LMNAALDH1A1SMN1; SMN2MAPTMAPK1
SCHEMBL12929643 0.85 ALDH1A1 (0.72) LMNAALDH1A1SMN1; SMN2MAPTMAPK1
SCHEMBL12929579 0.84 ALDH1A1 (0.58) LMNAALDH1A1SMN1; SMN2MAPTMAPK1
SCHEMBL3572484 0.82 ALDH1A1 (0.78) LMNAALDH1A1SMN1; SMN2MAPTMAPK1
SCHEMBL3220326 0.82 HPGDS (0.51) LMNAALDH1A1SMN1; SMN2RAB9ANPC1
SCHEMBL12929631 0.81 KMT2A (0.59) LMNAALDH1A1SMN1; SMN2MAPTMAPK1
Hydrochloric Acid SCHEMBL3217961 0.81 HPGDS (0.50) ALDH1A1SMN1; SMN2RAB9ANPC1L3MBTL1
SCHEMBL3217950 0.81 HPGDS (0.50) LMNAALDH1A1SMN1; SMN2L3MBTL1KDM4E
SCHEMBL22584043 0.81 GRM5 (0.51) ALDH1A1SMN1; SMN2MAPTNPSR1L3MBTL1
SCHEMBL12929496 0.81 KMT2A (0.58) LMNAALDH1A1SMN1; SMN2MAPTMAPK1

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 5 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 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 LMNA 3470/4885ALDH1A1 298/4885SMN1; SMN2 4832/4885

“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.