Pyrimidine

Pyrimidine

SCHEMBL10587452

c1cncnc1.c1ncncn1

nearest known ligand 0.46

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Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.46
NAPRT Q6XQN6 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
CYP2A6 P11509 2/20 0.38
ALDH1A1 P00352 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32

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
Pyrimidine SCHEMBL19437633 0.95 TSHR (0.50) TSHRNAPRTTDP1CYP2A6ALDH1A1
Pyrimidine SCHEMBL1846 0.95
Pyrimidine SCHEMBL10646 0.95 TSHR (0.50) TSHRNAPRTTDP1CYP2A6ALDH1A1
Pyrimidine SCHEMBL9545353 0.90
Pyrimidine SCHEMBL3987505 0.90
Pyrimidine SCHEMBL9120472 0.90
Benzene SCHEMBL10697562 0.90 TSHR (0.58) TSHRNAPRTTDP1CYP2A6ALDH1A1
Pyrimidine SCHEMBL21315895 0.90 TSHR (0.46) TSHRNAPRTTDP1CYP2A6ALDH1A1
Pyrimidine SCHEMBL22346941 0.90
Pyrimidine SCHEMBL383109 0.90

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
CN-112794843-B Compound for organic photoelectric device, composition for organic photoelectric device, and display device 三星SDI株式会社 2024-07-05 CN disclosed
CN-111433927-B Compound for electron transport layer and organic electroluminescent element comprising same 索路思高新材料有限公司 2024-05-28 CN disclosed
US-20220399518-A1 BLUE ORGANIC LIGHT-EMITTING DIODE AND DISPLAY DEVICE BOE TECHNOLOGY GROUP CO., LTD. (CN) 2022-12-15 US disclosed
US-20210151688-A1 COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, COMPOSITION FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC OPTOELECTRONIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2021-05-20 US disclosed
CN-112794843-A Compound for organic photoelectric device, composition for organic photoelectric device, and display device 三星SDI株式会社 2021-05-14 CN disclosed
CN-111864096-A Blue organic light emitting diode and display device 京东方科技集团股份有限公司 2020-10-30 CN disclosed
CN-111433927-A Compound for electron transport layer and organic electroluminescent element comprising same 斗山索如始株式会社 2020-07-17 CN disclosed
EP-0324391-A2 Method for the formation of high-contrast images KONICA CORPORATION (JP) 1989-07-19 EP disclosed