SCHEMBL3454164

SCHEMBL3454164

Nc1nc2c(c(=O)[nH]1)NCCN2

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NOS1 P29475 10/20 0.53
▸ NOS3 P29474 2/20 0.48
▸ NOS2 P35228 2/20 0.48
▸ CASP7 P55210 2/20 0.47
▸ HSD17B10 Q99714 2/20 0.47
▸ USP2 O75604 1/20 0.47
▸ PAH P00439 1/20 0.47
▸ MAPT P10636 3/20 0.46
▸ KDM4E B2RXH2 2/20 0.46
▸ BLM P54132 2/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ GLA P06280 1/20 0.46
▸ HPGD P15428 1/20 0.46
▸ PMP22 Q01453 1/20 0.46
▸ NPSR1 Q6W5P4 1/20 0.46
▸ TDP1 Q9NUW8 1/20 0.46
▸ CDK1 P06493 1/20 0.41
▸ CDK4 P11802 1/20 0.41
▸ CDK2 P24941 1/20 0.41

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
SCHEMBL2523525 0.84 NOS1 (0.53) NOS1NOS3NOS2CASP7HSD17B10
SCHEMBL26018101 0.76 NOS1 (0.32) NOS1CASP7HSD17B10USP2MAPT
SCHEMBL12102081 0.76 ALDH1A1 (0.38) NOS1NOS3NOS2USP2MAPT
SCHEMBL17556623 0.76 NOS1 (0.49) NOS1NOS3NOS2CASP7HSD17B10
Acetic Acid SCHEMBL10480604 0.75 NOS1 (0.47) NOS1NOS3NOS2CASP7HSD17B10
SCHEMBL10064935 0.74 TYMS (0.41) NOS1NOS3NOS2PNP
SCHEMBL584982 0.72 NOS1 (0.64) NOS1NOS3NOS2CASP7HSD17B10
SCHEMBL29501873 0.72 NOS1 (0.30) NOS1NOS3NOS2
SCHEMBL29016448 0.72 TYMS (0.37) NOS1NOS3NOS2
SCHEMBL2727252 0.72 LMNA (0.51) NOS1NOS3NOS2MAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119925601-A Application of tetrahydrobiopterin pathway as target in anti-QDPR deletion type tumor 中山大学肿瘤防治中心(中山大学附属肿瘤医院、中山大学肿瘤研究所) 2025-05-06 — — CN claimed
EP-1116721-B1 Process for the reduction of pterines CERBIOS PHARMA SA (CH) 2003-03-12 — — EP claimed
EP-1116721-A1 Process for the reduction of pterines Cerbios-Pharma S.A. (CH) 2001-07-18 — — EP claimed
US-6162914-A Process for the reduction of pterins CERBIOS-PHARMA S.A. (CH) 2000-12-19 — — US claimed
JP-7188232-A — — None — — JP disclosed
CN-120060106-A Genetically engineered bacterium and method for producing 5-hydroxytryptophan by whole cell catalysis 山西师范大学 2025-05-30 — — CN disclosed
CN-119925601-A Application of tetrahydrobiopterin pathway as target in anti-QDPR deletion type tumor 中山大学肿瘤防治中心(中山大学附属肿瘤医院、中山大学肿瘤研究所) 2025-05-06 — — CN disclosed
CN-118460586-A Overexpression vector, cofactor-independent 5-HTP synthetic strain, method and application 天津科技大学 2024-08-09 — — CN disclosed
WO-2023016134-A1 COMPOUND CONTAINING TETRAHYDROPTERIN STRUCTURE, AND PREPARATION METHOD THEREFOR AND USE THEREOF 中国药科大学 2023-02-16 — — WO disclosed
EP-2162456-B1 Stable crystalline (6S)-N(5)-methyl-5,6,7,8-tetrahydrofolic acid, process for its preparation and its use CERBIOS PHARMA SA (CH) 2011-07-06 — — EP disclosed
US-7816525-B1 Process for the preparation of optically pure tetrahydropterins and derivatives, and specifically of optically pure tetrahydrofolic acid and derivatives thereof, by stereospecific hydrogenation Merck & Cie (CH) 2010-10-19 — — US disclosed
US-7816525-B1 Process for the preparation of optically pure tetrahydropterins and derivatives, and specifically of optically pure tetrahydrofolic acid and derivatives thereof, by stereospecific hydrogenation Merck & Cie (CH) 2010-10-19 — — US disclosed
EP-1116721-B1 Process for the reduction of pterines CERBIOS PHARMA SA (CH) 2003-03-12 — — EP disclosed
EP-1200437-A1 METHOD FOR PRODUCING BY STEREOSPECIFIC HYDRATION TETRAHYDROPTERINS AND OPTICALLY PURE DERIVATIVES, IN PARTICULAR TETRAHYDROFOLIC ACID AND ITS OPTICALLY PURE DERIVATIVES EPROVA AG Forschungsinstitut (CH) 2002-05-02 — — EP disclosed
EP-1116721-A1 Process for the reduction of pterines Cerbios-Pharma S.A. (CH) 2001-07-18 — — EP disclosed
EP-1116721-A1 Process for the reduction of pterines Cerbios-Pharma S.A. (CH) 2001-07-18 — — EP disclosed
WO-2001004120-A1 METHOD FOR PRODUCING BY STEREOSPECIFIC HYDRATION TETRAHYDROPTERINS AND OPTICALLY PURE DERIVATIVES, IN PARTICULAR TETRAHYDROFOLIC ACID AND ITS OPTICALLY PURE DERIVATIVES EPROVA AG (CH) 2001-01-18 — — WO disclosed
US-6162914-A Process for the reduction of pterins CERBIOS-PHARMA S.A. (CH) 2000-12-19 — — US disclosed
US-6162914-A Process for the reduction of pterins CERBIOS-PHARMA S.A. (CH) 2000-12-19 — — US disclosed
JP-H07188232-A CELL DAMAGE SUPPRESSING AGENT ASAHI BREWERIES LTD 1995-07-25 — — JP disclosed
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