SCHEMBL580823

SCHEMBL580823

c1ccc(-c2ncccn2)nc1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.75
TP53 P04637 4/20 0.75
TDP1 Q9NUW8 3/20 0.75
LMNA P02545 3/20 0.72
CCR1 P32246 2/20 0.72
CCR5 P51681 2/20 0.72
CCR8 P51685 2/20 0.72
METAP1 P53582 2/20 0.72
CYP1A2 P05177 1/20 0.72
POLB P06746 1/20 0.72
BLM P54132 1/20 0.72
HIF1A Q16665 1/20 0.72
DOHH Q9BU89 1/20 0.72
P4HTM Q9NXG6 1/20 0.72
ALOX15 P16050 4/20 0.60
L3MBTL1 Q9Y468 4/20 0.60
NPC1 O15118 7/20 0.59
RAB9A P51151 7/20 0.59
SMN1; SMN2 Q16637 4/20 0.59
HTT P42858 3/20 0.59

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
SCHEMBL31268013 1.00 KDM4E (0.75) KDM4ETP53TDP1LMNACCR1
Hydrochloric Acid SCHEMBL28577751 0.97 KDM4E (0.71) KDM4ETP53TDP1LMNACCR1
SCHEMBL1397375 0.87 KDM4E (0.58) KDM4ETP53TDP1LMNACCR1
SCHEMBL30694104 0.86 TP53 (1.00) KDM4ETP53TDP1LMNACCR1
SCHEMBL29354466 0.86 KDM4E (1.00) KDM4ETP53TDP1LMNACCR1
SCHEMBL2852298 0.86 TP53 (1.00) KDM4ETP53TDP1LMNACCR1
SCHEMBL322756 0.86 KDM4E (1.00) KDM4ETP53TDP1LMNACCR1
SCHEMBL29767699 0.86 TP53 (1.00) KDM4ETP53TDP1LMNACCR1
SCHEMBL21315705 0.85 KDM4E (0.55) KDM4ETP53TDP1LMNACCR1
SCHEMBL131504 0.85 KDM4E (0.62) KDM4ETP53TDP1LMNACCR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240349602-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2024-10-17 US claimed
CN-115093396-B Pyridinylether compound containing pyrimidamine and preparation method and application thereof 湖南化工研究院有限公司 2024-03-29 CN claimed
CN-112204765-A Photoelectric conversion element and method for manufacturing photoelectric conversion element 索尼公司 2021-01-08 CN claimed
CN-105541795-B Pyridyl-pyrimidine class compound and its synthetic method and application 南京林业大学 2018-01-19 CN claimed
CN-107434801-A A kind of 4 ' pyridyl-pyrimidine class compounds and its synthetic method and application 南京林业大学 2017-12-05 CN claimed
CN-105541795-A Pyridyl pyrimidine compound and synthesizing method and application thereof UNIV NANJING FORESTRY 2016-05-04 CN claimed
US-9156843-B2 Organic electroluminescent device comprising an organic layer containing an indolocarbazole compound NIPPON STEEL & SUMIKIN CHEMICAL CO., LTD. (JP) 2015-10-13 US claimed
CN-102432634-A 2-amino-4- (2' -pyridine) -pyrimidine diperoxovanadium ammonium salt complex and single crystal culture and application thereof UNIV HENAN SCIENCE & TECH 2012-05-02 CN claimed
CN-102391304-A 4-(2'-pyridine)-pyrimidine diperoxovanadate ammonium salt coordination compound and single crystal culture method and application thereof UNIV HENAN SCIENCE & TECH 2012-03-28 CN claimed
US-20110144140-A1 PYRIDINYL-PYRIMIDINE DERIVATIVES USEFUL AS POTASSIUM CHANNEL MODULATING AGENTS NEUROSEARCH A/S (DK) 2011-06-16 US claimed
EP-0431424-A2 Pyridinylpyrimidin derivatives BAYER AG (DE) 1991-06-12 EP claimed
EP-0234104-B1 NOVEL PYRIDINYLPYRIMIDINE DERIVATIVES, METHOD FOR PRODUCTION THEREOF AND A PLANT DISEASE PROTECTANT CONTAINING THEM AS THE ACTIVE INGREDIENT SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1990-10-24 EP claimed
US-4927827-A Pyridinylpyrimidine derivatives, method for production thereof and a fungicide containing them as the active ingredient SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1990-05-22 US claimed
US-4873248-A Pyridinylpyrimidines having fungicidal activity SUMITOMO CHEMICAL CO., LTD. (JP) 1989-10-10 US claimed
US-4783466-A Novel pyridinylpyrimidine derivatives, method for production thereof and a plant disease protectant containing them as the active ingredient SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1988-11-08 US claimed
US-4769376-A Certain tri- or tetra-substituted pyridyl-1,2,4-triazoles useful as fungicides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1988-09-06 US claimed
US-4752608-A Fungicidal pyridinylpyrimidine derivatives SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1988-06-21 US claimed
EP-0270362-A2 Pyridinylpyrimidine derivatives, method for production thereof and a fungicide containing them as the active ingredient SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1988-06-08 EP claimed
EP-0259139-A2 Pyridinylpyrimidine derivatives, method for production thereof and a plant disease protectant containing them as the active ingredient SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1988-03-09 EP claimed
EP-0234104-A2 Novel pyridinylpyrimidine derivatives, method for production thereof and a plant disease protectant containing them as the active ingredient SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1987-09-02 EP claimed

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-20110144140-A1 PYRIDINYL-PYRIMIDINE DERIVATIVES USEFUL AS POTASSIUM CHANNEL MODULATING AGENTS KCNJ2, KCNN2, KCNN1 KDM4E 1122/4885TP53 4312/4885TDP1 1491/4885

“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.