SCHEMBL22393

SCHEMBL22393

O=P(O)(O)O[C@H]1C(OP(=O)(O)OP(=O)(O)O)O[C@H](CO)[C@H]1O

nearest known ligand 0.52

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 1/20 0.40
ADORA1 P30542 1/20 0.39
ITPR3 Q14573 1/20 0.39

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
Pyrophosphoric Acid SCHEMBL7582145 0.98 SMPD1 (0.39) SMPD1ADORA1ITPR3
SCHEMBL30007287 0.98 SMPD1 (0.39) SMPD1ADORA1ITPR3
SCHEMBL30360450 0.95 P2RY14 (0.39)
SCHEMBL4143599 0.89 SMPD1 (0.47) SMPD1ITPR3
SCHEMBL29656742 0.86 P2RY14 (0.47)
SCHEMBL3360274 0.86 P2RY14 (0.47)
SCHEMBL7541741 0.84 P2RY14 (0.49)
SCHEMBL7568898 0.84 P2RY14 (0.49)
SCHEMBL7568905 0.84 P2RY14 (0.49)
SCHEMBL7568791 0.84 P2RY14 (0.49)

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 1711 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4747627-A1 METHODS AND SYSTEMS FOR PREDICTIVE CLASSIFICATION BY MASS SPECTROMETRY AND TRAINED LARGE SPECTRAL MODELS Matterworks Inc (US) 2026-05-27 EP claimed
EP-3869192-B1 METHOD FOR QUANTITATIVE DETECTION OF VARIOUS METABOLITES IN BIOLOGICAL SAMPLE HUMAN METABOLOMICS INST INC (CN) 2026-05-13 EP claimed
CN-122029287-A Method for producing NMN and method for producing NAD 东方酵母工业株式会社 2026-05-12 CN claimed
CN-121574893-A Genetic engineering bacterium for catalyzing synthesis of cerulosa from cerulosa derivative, construction method and application thereof 南京玖合生物科技有限公司 2026-02-27 CN claimed
EP-4692364-A1 METHOD FOR PRODUCING SUBSTANCE Mitsubishi Chemical Corporation (JP) 2026-02-11 EP claimed
US-20260028656-A1 METHOD FOR PRODUCING SUBSTANCE MITSUBISHI CHEMICAL CORPORATION (JP) 2026-01-29 US claimed
US-20250258146-A1 QUANTITATIVE DETECTION METHOD OF MULTIPLE METABOLITES IN BIOLOGICAL SAMPLE AND METABOLIC CHIP HUMAN METABOLOMICS INSTITUTE INC. (CN) 2025-08-14 US claimed
US-12329726-B2 Biomarkers for efficacy of prophylactic treatments against stress-induced affective disorders THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2025-06-17 US claimed
CN-116064702-B Method for producing nicotinamide mononucleotide 旭化成制药株式会社 2025-06-10 CN claimed
WO-2025089354-A1 METHOD FOR PRODUCING NMN AND METHOD FOR PRODUCING NAD オリエンタル酵母工業株式会社 2025-05-01 WO claimed
US-7598031-B2 Method for the detection of gene transcripts in blood and uses thereof GENENEWS CORPORATION (CA) 2009-10-06 US claimed
US-20090246803-A1 NAD BIOSYNTHESIS SYSTEMS WASHINGTON UNIVERSITY (US) 2009-10-01 US claimed
WO-2009020596-A2 EMBRYONIC CEREBROSPINAL FLUIS (E-CSF), PROTEINS FROM E-CSF, AND RELATED METHODS AND COMPOSITIONS BETH ISRAEL DEACONESS MEDICAL CENTER (US) 2009-02-12 WO claimed
WO-2008043849-A2 PLANTS WITH INCREASED YIELD BASF PLANT SCIENCE GMBH (DE) 2008-04-17 WO claimed
WO-2006041624-A2 NAD BIOSYNTHESIS SYSTEMS WASHINGTON UNIVERSITY (US) 2006-04-20 WO claimed
CN-1361262-A New polypeptide hypoxanthine phosphoribosyl pyrophosphate transferase 32.34 and polynucleotides encoding this polypeptide BODE GENE DEV CO LTD SHANGHAI (CN) 2002-07-31 CN claimed
US-6258554-B1 SELECTING PARENT STRAIN FROM CORYNEBACTERIUM, BREVIBACTERIUM OR ESCHERICHIA HAVING TRANSKELOLASE ACTIVITY, REDUCING OR DEACTIVATING TRANSKETOLASE, AND THEN DECTECTING INCREASE IN PRODUCTIVITY OF PHOSPHORIBOSYL PYROPHOSPHATE KYOWA HAKKO KOGYO CO., LTD. (JP) 2001-07-10 US claimed
EP-0994952-A1 PLANT ATP-PHOSPHORIBOSYL TRANSFERASE AND DNA CODING THEREFOR Novartis AG (CH) 2000-04-26 EP claimed
EP-0969096-A1 Method for producing metabolites biologically synthesized via phosphoribosyl pyrophosphate KYOWA HAKKO KOGYO KABUSHIKI KAISHA (JP) 2000-01-05 EP claimed
WO-1999005286-A1 PLANT ATP-PHOSPHORIBOSYL TRANSFERASE AND DNA CODING THEREFOR NOVARTIS AG (CH) 1999-02-04 WO 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-20260028656-A1 METHOD FOR PRODUCING SUBSTANCE NADK, NAMPT, PRPS1 SMPD1 689/4885ADORA1 143/4885ITPR3 1087/4885

“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.