Pyrimidine

Pyrimidine

SCHEMBL6803512

O=c1cc[nH][nH]1.c1cncnc1

nearest known ligand 0.36

Full drug profile on Sugi Atlas →

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.36
AOC3 Q16853 1/20 0.36
CYP2A6 P11509 1/20 0.31
FKBP5 Q13451 1/20 0.30

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
Pyridine SCHEMBL3397522 0.87 TSHR (0.39) ALDH1A1AOC3FKBP5
SCHEMBL57548 0.81
Hydrochloric Acid SCHEMBL7215896 0.78
Ammonia Solution, Strong SCHEMBL3496228 0.78
Methane SCHEMBL190372 0.78 ALDH1A1 (0.50) ALDH1A1AOC3FKBP5
SCHEMBL17474379 0.78
Imidazole SCHEMBL10529226 0.75 ALDH1A1 (0.52) ALDH1A1AOC3FKBP5
Naphthalene SCHEMBL3488502 0.75 PARP1 (0.41) ALDH1A1AOC3CYP2A6FKBP5
Oxazole SCHEMBL9345569 0.72 ALDH1A1 (0.31) ALDH1A1AOC3
SCHEMBL6598535 0.72

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112142747-A Pyrazolone pyrimidine compound, preparation method and application thereof 上海医药集团股份有限公司 2020-12-29 CN claimed
CN-112142748-A Pyrazolone pyrimidine compound, preparation method and application thereof 上海医药集团股份有限公司 2020-12-29 CN claimed
CN-112142763-A Pyrazolone pyrimidine compound, preparation method and application thereof 上海医药集团股份有限公司 2020-12-29 CN claimed
CN-1426776-A Composition for oxidation dyeing of keratin fibre OREAL (FR) 2003-07-02 CN claimed
US-6197071-B1 HAIR DYES; LIGHT STABILITY; COLOR PHOTOGRAPHY EASTMAN KODAK COMPANY 2001-03-06 US claimed
CN-111315747-B Dihydropyrazolopyrimidine compound and preparation method and application thereof 四川科伦博泰生物医药股份有限公司 2023-05-02 CN disclosed
CN-111315747-B Dihydropyrazolopyrimidine compound and preparation method and application thereof 四川科伦博泰生物医药股份有限公司 2023-05-02 CN disclosed
CN-112142747-A Pyrazolone pyrimidine compound, preparation method and application thereof 上海医药集团股份有限公司 2020-12-29 CN disclosed
CN-112142763-A Pyrazolone pyrimidine compound, preparation method and application thereof 上海医药集团股份有限公司 2020-12-29 CN disclosed
CN-112142763-A Pyrazolone pyrimidine compound, preparation method and application thereof 上海医药集团股份有限公司 2020-12-29 CN disclosed
CN-112142748-A Pyrazolone pyrimidine compound, preparation method and application thereof 上海医药集团股份有限公司 2020-12-29 CN disclosed
CN-112142748-A Pyrazolone pyrimidine compound, preparation method and application thereof 上海医药集团股份有限公司 2020-12-29 CN disclosed
CN-102295703-A Methods for identifying tumors that are responsive to treatment with anti-ErbB2 antibodies 2011-12-28 CN disclosed
CN-101711866-A Method for identifying tumors that are responsive to treatment with anti-ErbB2 antibodies HENENTECH INC 2010-05-26 CN disclosed
CN-1835768-A Methods of identifying tumors responsive to treatment with anti-ErbB 2 antibodies GENENTECH INC (US) 2006-09-20 CN disclosed
CN-1267790-C Automatic developing device and method for supplementing developing liquid FUJI PHOTO FILM CO LTD (JP) 2006-08-02 CN disclosed
CN-1771026-A Drug delivery system comprising an encapsulated active ingredient PROCTER & GAMBLE (US) 2006-05-10 CN disclosed
US-20040121952-A1 Treatment of cancer CHILDREN'S MEDICAL CENTER CORPORATION (US) 2004-06-24 US disclosed
CN-1312490-A Automatic developing device and method for supplementing developing liquid FUJI PHOTO FILM CO LTD (JP) 2001-09-12 CN disclosed
US-RE30199-E Oxidation hair dyes based upon tetraaminopyrimidine developers HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (HENKEL KGAA) (DE) 1980-01-29 US disclosed