SCHEMBL12083712

SCHEMBL12083712

Cc1nc(-c2ccccn2)ncc1C(=O)Nn1c(C)cc2cc(F)ccc21

nearest known ligand 0.68

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ HPGDS O60760 6/20 0.68
▸ GLA P06280 1/20 0.43
▸ RAB9A P51151 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ CTSD P07339 1/20 0.38
▸ GUSB P08236 1/20 0.38
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ KAT6A Q92794 1/20 0.37
▸ HRH3 Q9Y5N1 1/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.36
▸ F2 P00734 1/20 0.36
▸ F12 P00748 1/20 0.36

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
SCHEMBL12083668 0.88 HPGDS (0.52) HPGDSGLARAB9AL3MBTL1CTSD
SCHEMBL12083843 0.85 HPGDS (0.74) HPGDSGLARAB9AL3MBTL1CTSD
SCHEMBL12083549 0.84 HPGDS (0.52) HPGDSMEN1KMT2A
SCHEMBL14313023 0.84 HPGDS (0.51) HPGDSGLARAB9AL3MBTL1MEN1
SCHEMBL12083687 0.84 HPGDS (0.49) HPGDSKMT2AF2
SCHEMBL14313102 0.82 HPGDS (0.48) HPGDSRAB9AL3MBTL1CTSDGUSB
SCHEMBL2474438 0.81 HPGDS (1.00) HPGDSGLARAB9AL3MBTL1CTSD
SCHEMBL3220415 0.80 HPGDS (0.83) HPGDSGLARAB9AL3MBTL1CTSD
SCHEMBL12083980 0.78 HPGDS (0.52) HPGDSL3MBTL1MEN1KMT2AKAT6A
SCHEMBL12084042 0.78 HPGDS (0.81) HPGDSGLARAB9AL3MBTL1CTSD

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
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-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
US-20100048568-A1 PYRIMIDINE HYDRAZIDE COMPOUNDS AS PGDS INHIBITORS SANOFI-AVENTIS (FR) 2010-02-25 — — US 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 HPGDS 10/4885GLA 1529/4885RAB9A 2033/4885

“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.

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