SCHEMBL4882183

SCHEMBL4882183

c1ncnc(-c2ncco2)n1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HPGDS O60760 1/20 0.41
LTA4H P09960 1/20 0.36
BRD4 O60885 1/20 0.32
ADORA2A P29274 2/20 0.31
ADORA1 P30542 2/20 0.31
GLRA3 O75311 1/20 0.31
GLRB P48167 1/20 0.31
HSP90AA1 P07900 1/20 0.31
CSNK1A1 P48729 1/20 0.31
CSNK1D P48730 1/20 0.31
CSNK1E P49674 1/20 0.31

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
SCHEMBL66901 0.80 HPGDS (0.48) HPGDSLTA4HBRD4ADORA2AADORA1
SCHEMBL100765 0.76 HPGDS (0.46) HPGDSLTA4HBRD4ADORA2AADORA1
SCHEMBL17701262 0.74 HPGDS (0.40) HPGDSLTA4HBRD4ADORA2AADORA1
SCHEMBL13114685 0.73 HPGDS (0.47) HPGDSLTA4HBRD4ADORA2AADORA1
SCHEMBL17701235 0.73 HPGDS (0.36) HPGDSLTA4H
SCHEMBL3079973 0.71 CYP2D6 (0.39) HPGDSLTA4HBRD4ADORA2AADORA1
SCHEMBL13737200 0.70 HPGDS (0.53) HPGDSLTA4HBRD4ADORA2AGLRA3
SCHEMBL14211174 0.69 HPGDS (0.43) HPGDSLTA4HBRD4ADORA2AADORA1
SCHEMBL5507183 0.68 PPARA (0.40) HPGDSLTA4HBRD4ADORA2AADORA1
SCHEMBL31351956 0.67 PIN1 (0.39) HPGDSLTA4HBRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102464611-A Substitutional biaryl base benzene sulfonamide compound and application SINOCHEM CORP 2012-05-23 CN claimed
CN-102459289-A Copper complexes for optoelectronic applications HARTMUT YERSIN 2012-05-16 CN claimed
CN-101959884-A 6-heterocyclic imidazo [1, 2-alpha ] pyridine-2-carboxamide derivatives, preparation and therapeutic use thereof SANOFI AVENTIS 2011-01-26 CN claimed
CN-100497326-C 1-piperazine-and 1-homopiperazine-carboxylate derivatives, preparation and therapeutic use thereof SANOFI AVENTIS (FR) 2009-06-10 CN claimed
CN-113214270-A Compounds and derivatives thereof as MDM2-P53 inhibitors 勃林格殷格翰国际有限公司 2021-08-06 CN disclosed
CN-108148063-A Compound dimethoxy-styryl-amino-benzimidazole base-triazine and its salt and preparation method and application 华南理工大学 2018-06-12 CN disclosed
US-9812315-B2 Treating solution for electronic parts, and process for producing electronic parts FINE POLYMERS CORPORATION (JP) 2017-11-07 US disclosed
US-20150279654-A1 TREATING SOLUTION FOR ELECTRONIC PARTS, AND PROCESS FOR PRODUCING ELECTRONIC PARTS FINE POLYMERS CORPORATION (JP) 2015-10-01 US disclosed
CN-103732065-A Benzofuran compounds for the treatment of hepatitis c virus infections GLAXO GROUP LTD 2014-04-16 CN disclosed
CN-101068825-B Having a2A2-propynyl adenosine analogs with modified 5' -ribose groups for agonist activity Univ Virginia Patent Found 2013-05-08 CN disclosed
CN-101959884-B 6-heterocyclic imidazo [1,2-a ] pyridine-2-carboxamide derivatives, preparation and therapeutic use thereof SANOFI AVENTIS 2013-02-27 CN disclosed
CN-101541764-B Pyrimidylmethyl-sulfonamide compounds useful as fungicides and against arthropods BASF SE 2012-10-10 CN disclosed
US-20080107608-A1 5-Substituted-2-Arylpyridines GE PING 2008-05-08 US disclosed
CN-101146889-A Luminous compound containing lanthanide ion FUJIFILM CORP (JP) 2008-03-19 CN disclosed
US-20070190523-A1 Method and compositions for identifying anti-hiv therapeutic compounds GILEAD SCIENCES, INC. 2007-08-16 US disclosed
CN-1708571-A Process for incorporation of UV-luminescent compounds in polymeric materials CIBA SC HOLDING AG (CH) 2005-12-14 CN disclosed
US-6667306-B1 Aminobenzothiazole and aminobenzoxazole derivatives; thrombosis MILLENNIUM PHARMACEUTICALS, INC. 2003-12-23 US disclosed
EP-1047699-A1 PLATELET ADP RECEPTOR INHIBITORS COR THERAPEUTICS, INC. (US) 2000-11-02 EP disclosed
WO-1999036425-A1 PLATELET ADP RECEPTOR INHIBITORS COR THERAPEUTICS, INC. (US) 1999-07-22 WO disclosed
CN-1200117-A Phenylacetic acids, processes for their preparation and agents containing them BASF AG (DE) 1998-11-25 CN 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-20080107608-A1 5-Substituted-2-Arylpyridines CRHR2, CRHR1, HTR2C HPGDS 1530/4885LTA4H 3187/4885BRD4 1835/4885

“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.