SCHEMBL12084155

SCHEMBL12084155

Cc1nc(-c2cccc(F)c2)ncc1C(=O)Nn1cc(C)c2ccncc21

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ HPGDS O60760 6/20 0.60
▸ CSNK2A2 P19784 2/20 0.39
▸ CSNK2B P67870 2/20 0.39
▸ ROCK2 O75116 1/20 0.39
▸ GRIN1 Q05586 1/20 0.36
▸ GRIN2B Q13224 1/20 0.36
▸ CSNK1D P48730 1/20 0.36
▸ JAK2 O60674 1/20 0.36
▸ JAK1 P23458 1/20 0.36
▸ TYK2 P29597 1/20 0.36
▸ JAK3 P52333 1/20 0.36
▸ MAP4K4 O95819 1/20 0.35
▸ DGAT1 O75907 1/20 0.35
▸ DGAT2 Q96PD7 2/20 0.35
▸ BRAF P15056 1/20 0.35
▸ CSNK2A1 P68400 1/20 0.35

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
SCHEMBL12083808 0.93 HPGDS (0.63) HPGDSCSNK2A2CSNK2BROCK2GRIN1
SCHEMBL12083974 0.90 HPGDS (0.51) HPGDSCSNK2A2CSNK2BROCK2GRIN1
SCHEMBL12083584 0.88 HPGDS (0.74) HPGDSCSNK1DMAP4K4DGAT1
SCHEMBL3220594 0.85 HPGDS (0.52) HPGDSCSNK2A2CSNK2BROCK2GRIN1
SCHEMBL14313343 0.85 HPGDS (0.44) HPGDSCSNK2A2CSNK2BROCK2GRIN1
SCHEMBL12083810 0.84 HPGDS (0.60) HPGDSGRIN2BCSNK1DMAP4K4DGAT1
SCHEMBL12083577 0.84 HPGDS (0.73) HPGDS
SCHEMBL12084181 0.83 HPGDS (0.55) HPGDSCSNK1DMAP4K4DGAT1
SCHEMBL12084096 0.83 HPGDS (0.62) HPGDS
SCHEMBL12084086 0.83 HPGDS (0.62) HPGDSCSNK1D

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 10/4885CSNK2A2 2826/4885CSNK2B 2278/4885

“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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