SCHEMBL3810374

SCHEMBL3810374

Cc1nc(-c2cccc(F)c2)ncc1C(=O)Nn1ccc2cc(Br)ccc21

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ HPGDS O60760 6/20 0.51
▸ CSNK1D P48730 1/20 0.37
▸ SLC6A2 P23975 1/20 0.36
▸ SLC6A4 P31645 1/20 0.36
▸ PTGFR P43088 2/20 0.36
▸ FOS P01100 1/20 0.36
▸ JUN P05412 1/20 0.36
▸ NFKB1 P19838 1/20 0.36
▸ NFKB2 Q00653 1/20 0.36
▸ RELA Q04206 1/20 0.36
▸ DGAT1 O75907 1/20 0.36
▸ CXCR4 P61073 1/20 0.35
▸ POLQ O75417 1/20 0.35
▸ HDAC1 Q13547 1/20 0.34
▸ HDAC6 Q9UBN7 1/20 0.34
▸ MAP4K4 O95819 1/20 0.34
▸ IDO1 P14902 1/20 0.34
▸ AMY1A P0DUB6 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
SCHEMBL3217764 0.92 HPGDS (0.54) HPGDSCSNK1DDGAT1POLQHDAC1
SCHEMBL12083909 0.89 HPGDS (0.51) HPGDSCSNK1DDGAT1POLQMAP4K4
SCHEMBL2471757 0.89 HPGDS (0.54) HPGDSCSNK1DDGAT1POLQMAP4K4
SCHEMBL14041378 0.88 HPGDS (0.51) HPGDSCSNK1DDGAT1POLQHDAC1
SCHEMBL12083923 0.87 HPGDS (0.54) HPGDSCSNK1DDGAT1
SCHEMBL12083724 0.87 HPGDS (0.50) HPGDSCSNK1DFOSJUNNFKB1
SCHEMBL12084048 0.86 HPGDS (0.49) HPGDSCSNK1DDGAT1MAP4K4
SCHEMBL12084161 0.86 HPGDS (0.49) HPGDSCSNK1DSLC6A2FOSJUN
SCHEMBL12083978 0.85 HPGDS (0.49) HPGDSDGAT1MAP4K4
SCHEMBL14313344 0.85 HPGDS (0.40) HPGDSCSNK1DSLC6A2SLC6A4PTGFR

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 8 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
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
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 10/4885CSNK1D 1144/4885SLC6A2 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.

Send feedback