SCHEMBL188064

SCHEMBL188064

N=CN1c2c(nc(N)[nH]c2=O)NCC1CNc1ccc(C(=O)NC(CCC(=O)O)C(=O)O)cc1

nearest known ligand 0.87

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DHFR P00374 1/20 0.87
MTHFD1 P11586 3/20 0.70
LMNA P02545 1/20 0.69
SOST Q9BQB4 1/20 0.66
MTHFD2 P13995 3/20 0.61
FPGS Q05932 2/20 0.59
TYMS P04818 1/20 0.55
GART P22102 5/20 0.54
ATIC P31939 2/20 0.54

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
SCHEMBL13418314 1.00 DHFR (0.87) DHFRMTHFD1LMNASOSTMTHFD2
SCHEMBL258924 1.00 DHFR (0.87) DHFRMTHFD1LMNASOSTMTHFD2
SCHEMBL29616604 1.00 DHFR (0.87) DHFRMTHFD1LMNASOSTMTHFD2
SCHEMBL3181068 1.00 DHFR (0.87) DHFRMTHFD1LMNASOSTMTHFD2
Leucovorin SCHEMBL3031362 0.93 DHFR (1.00) DHFRMTHFD1LMNASOSTMTHFD2
Folinic Acid SCHEMBL29616563 0.93 DHFR (1.00) DHFRMTHFD1LMNASOSTMTHFD2
Folinic Acid SCHEMBL21498299 0.93 DHFR (1.00) DHFRMTHFD1LMNASOSTMTHFD2
Leucovorin SCHEMBL29385578 0.93 DHFR (1.00) DHFRMTHFD1LMNASOSTMTHFD2
Leucovorin SCHEMBL36113 0.93 DHFR (1.00) DHFRMTHFD1LMNASOSTMTHFD2
Leucovorin SCHEMBL29379632 0.93 DHFR (1.00) DHFRMTHFD1LMNASOSTMTHFD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240415837-A1 PHARMACOLOGIC MODULATION OF 5-FLUOROURACIL BY FOLINIC ACID AND VITAMIN B6 FOR THE TREATMENT OF PATIENTS WITH CARCINOMA MACHOVER DAVID (FR) 2024-12-19 US claimed
US-20210213020-A1 METHODS AND PHARMACEUTICAL COMPOSITIONS FOR TREATING CANCER INSERM INSTITUT NAT DE LA SANTE ET DE LA RECHIRCHE MEDICALE (FR) 2021-07-15 US claimed
EP-3801513-A1 METHODS AND PHARMACEUTICAL COMPOSITIONS FOR TREATING CANCER Machover, David (FR) 2021-04-14 EP claimed
US-20210085685-A1 Methods of Preventing or Treating Disease States Related to Certain Metabolic Abnormalities GLOBAL HEALTHCARE FOCUS, LLC 2021-03-25 US claimed
WO-2019229115-A1 METHODS AND PHARMACEUTICAL COMPOSITIONS FOR TREATING CANCER INSERM (Institut National de la Santé et de la Recherche Médicale) (FR) 2019-12-05 WO claimed
US-10357496-B2 Methods, formulations, and kits for rapidly repleting folate levels in women SOUTH ALABAMA MEDICAL SCIENCE FOUNDATION (US) 2019-07-23 US claimed
US-20180237781-A1 COMPOSITIONS AND METHODS FOR REGULATION OF GENE EXPRESSION WITH, AND DETECTION OF, FOLINIC ACID AND FOLATES THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2018-08-23 US claimed
EP-3027178-A2 STABILIZED MODIFIED RELEASE FOLIC ACID DERIVATIVE COMPOSITION, ITS THERAPEUTIC USE AND METHODS OF MANUFACTURE Adare Pharmaceuticals, Inc. (US) 2016-06-08 EP claimed
WO-2016025750-A2 COMPOSITIONS AND METHODS FOR REGULATION OF GENE EXPRESSION WITH, AND DETECTION OF, FOLINIC ACID AND FOLATES THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2016-02-18 WO claimed
WO-2015017423-A2 STABILIZED MODIFIED RELEASE FOLIC ACID DERIVATIVE COMPOSITION, ITS THERAPEUTIC USE AND METHODS OF MANUFACTURE APTALIS PHARMATECH, INC. (US) 2015-02-05 WO claimed
EP-1912641-A4 METHODS AND COMPOSITIONS CONTAINING NATURAL FOLATES FOR PROTECTING AGAINST RADIATION DAMAGE UNIV SOUTH ALABAMA (US) 2008-12-31 EP claimed
WO-2008137043-A1 METHODS AND COMPOSITIONS SOUTH ALABAMA MEDICAL SCIENCE FOUNDATION (US) 2008-11-13 WO claimed
EP-1912641-A2 METHODS AND COMPOSITIONS CONTAINING NATURAL FOLATES FOR PROTECTING AGAINST RADIATION DAMAGE South Alabama Medical Science Foundation (US) 2008-04-23 EP claimed
WO-2007002356-A2 METHODS AND COMPOSITIONS CONTAINING NATURAL FOLATES FOR PROTECTING AGAINST RADIATION DAMAGE SOUTH ALABAMA MEDICAL SCIENCE FOUNDATION (US) 2007-01-04 WO claimed
WO-2006119589-A2 PREVENTION AND THERAPY OF CEREBRAL FOLATE DEFICIENCY RAMAEKERS, VINCENT (BE) 2006-11-16 WO claimed
US-6921754-B2 Human and animal nutrition and dietary supplementation BASF AKTIENGESELLSCHAFT (DE) 2005-07-26 US claimed
US-20030143304-A1 Human and animal nutrition and dietary supplementation BASF AKTIENGESELLSCHAFT (DE) 2003-07-31 US claimed
EP-1282366-A2 COMPOSITIONS CONTAINING FOLIC ACID AND REDUCED FOLATE BASF AKTIENGESELLSCHAFT (DE) 2003-02-12 EP claimed
WO-2001084962-A2 COMPOSITIONS CONTAINING FOLIC ACID AND REDUCED FOLATE BASF AKTIENGESELLSCHAFT (DE) 2001-11-15 WO claimed
US-5800979-A Gas chromatography/mass spectrometric determination of folic acid coenzymes KOLHOUSE J FRED (US) 1998-09-01 US claimed