SCHEMBL692444

SCHEMBL692444

C=CCSc1ncccn1

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.58
HSD17B10 Q99714 1/20 0.43
HPGD P15428 1/20 0.43
GAA P10253 1/20 0.43
TP53 P04637 1/20 0.42
MAPK1 P28482 1/20 0.39
KDM4E B2RXH2 1/20 0.39
KMT2A Q03164 3/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
MEN1 O00255 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
ALDH1A1 P00352 1/20 0.37

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
Piperazine SCHEMBL27508163 0.88 L3MBTL1 (0.49) L3MBTL1HSD17B10HPGDGAATP53
SCHEMBL1950950 0.79 L3MBTL1 (0.52) L3MBTL1HSD17B10HPGDGAATP53
SCHEMBL6680308 0.78 GAA (0.49) L3MBTL1HSD17B10HPGDGAATP53
SCHEMBL29955418 0.76 HSD17B10 (0.43) L3MBTL1HSD17B10HPGDTP53MAPK1
SCHEMBL10973292 0.76 L3MBTL1 (0.58) L3MBTL1HSD17B10HPGDGAATP53
SCHEMBL11084732 0.76 L3MBTL1 (0.58) L3MBTL1HSD17B10HPGDGAATP53
SCHEMBL9592410 0.74 L3MBTL1 (1.00) L3MBTL1HPGDGAATP53MAPK1
SCHEMBL5738824 0.74 GAA (0.56) L3MBTL1HSD17B10HPGDGAATP53
SCHEMBL8194267 0.74 GAA (0.49) L3MBTL1HSD17B10HPGDGAATP53
SCHEMBL4311403 0.74 GAA (0.49) L3MBTL1HSD17B10HPGDGAATP53

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 151 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1242004-A Process for making 2-amino-2-imidazoline, guanidine, and 2-amino-3,4,5,6-tetrahydropyrimidine derivatives PROCTER & GAMBLE (US) 2000-01-19 CN claimed
EP-3660011-A1 BENZOIMIDAZOL-2-YL PYRIMIDINE MODULATORS OF THE HISTAMINE H4 RECEPTOR Janssen Pharmaceutica NV (BE) 2020-06-03 EP disclosed
WO-2018166528-A1 PYRIMIDINYL-PYRIDYLOXY-NAPHTHYL COMPOUNDS AND METHODS OF TREATING IRE1-RELATED DISEASES AND DISORDERS GENENTECH, INC. (US) 2018-09-20 WO disclosed
CN-108137638-A Bridging type nucleic acid GuNA, its manufacturing method and midbody compound 田边三菱制药株式会社 2018-06-08 CN disclosed
CN-105143209-B Biaryl amide compounds as kinase inhibitors 诺华股份有限公司 2018-03-13 CN disclosed
US-9732109-B2 Pesticidal compositions DOW AGROSCIENCES LLC (US) 2017-08-15 US disclosed
US-9663497-B2 Benzoimidazol-2-yl pyrimidine modulators of the histamine H4 receptor JANSSEN PHARMACEUTICA NV (BE) 2017-05-30 US disclosed
US-20160340337-A1 BENZOIMIDAZOL-2-YL PYRIMIDINE MODULATORS OF THE HISTAMINE H4 RECEPTOR NOVASSAY S.A. (CH) 2016-11-24 US disclosed
EP-2247603-B1 PESTICIDAL COMPOSITIONS DOW AGROSCIENCES LLC (US) 2016-09-28 EP disclosed
US-9434715-B2 Benzoimidazol-2-yl pyrimidine modulators of the histamine H4 receptor JANSSEN PHARMACEUTICA NV (BE) 2016-09-06 US disclosed
WO-1999001452-A1 NOVEL CYCLOALKYL SUBSTITUTED IMIDAZOLES SMITHKLINE BEECHAM CORPORATION (US) 1999-01-14 WO disclosed
WO-1999001131-A1 NOVEL SUBSTITUTED IMIDAZOLE COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 1999-01-14 WO disclosed
EP-0889726-A1 NOVEL CYCLOALKYL SUBSTITUTED IMIDAZOLES SMITHKLINE BEECHAM CORPORATION (US) 1999-01-13 EP disclosed
US-5756499-A Substituted imidazole compounds SMITHKLINE BEECHAM CORPORATION (US) 1998-05-26 US disclosed
WO-1997025045-A1 NOVEL SUBSTITUTED IMIDAZOLE COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 1997-07-17 WO disclosed
WO-1997025048-A1 NOVEL CYCLOALKYL SUBSTITUTED IMIDAZOLES SMITHKLINE BEECHAM CORPORATION (US) 1997-07-17 WO disclosed
US-4941910-A 4-halo-2-oxy or sulfonyl-4-amino substituted pyrimidines as herbicides BAYER AKTIENGESELLSCHAFT (DE) 1990-07-17 US disclosed
US-4711959-A REACTING 2-ALKYLSULPHONYL-PYRIMIDINE WITH CYANAMIDE OR METAL SALT OF CYANAMIDE BAYER AKTIENGESELLSCHAFT (DE) 1987-12-08 US disclosed
US-4352928-A ANTIINFLAMMATORY, HYPOGLYCEMIC, ANTICOAGULANT, ANOREXIGENIC, SEROTONIN EFFEC MITSUBISHI YUKA PHARMACEUTICAL CO., LTD. (JP) 1982-10-05 US disclosed
EP-0022481-A1 5,6-Alkylenepyrimidine derivatives, processes for preparing the same and pharmaceutical compositions Mitsubishi Yuka Pharmaceutical Co., Ltd. (JP) 1981-01-21 EP 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-20160340337-A1 BENZOIMIDAZOL-2-YL PYRIMIDINE MODULATORS OF THE HISTAMINE H4 RECEPTOR HRH4, HRH3, HRH2 L3MBTL1 4114/4885HSD17B10 4802/4885HPGD 1240/4885

“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.