SCHEMBL2746282

SCHEMBL2746282

NC(N)=NNc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 6/20 0.53
MAPT P10636 3/20 0.53
KDM4E B2RXH2 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
KMT2A Q03164 6/20 0.50
MEN1 O00255 5/20 0.50
RAB9A P51151 1/20 0.46
ALDH1A1 P00352 5/20 0.44
TSHR P16473 2/20 0.44
HSD17B10 Q99714 2/20 0.44
TP53 P04637 1/20 0.44
TYR P14679 1/20 0.44
TAS2R38 P59533 1/20 0.44
TDP1 Q9NUW8 4/20 0.43
LMNA P02545 3/20 0.43
CYP2D6 P10635 2/20 0.43
GRIN2D O15399 1/20 0.43
GRIN3B O60391 1/20 0.43
SLC6A2 P23975 1/20 0.43
GRIN1 Q05586 1/20 0.43

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
SCHEMBL18774078 0.81 GAA (0.51) GAAMAPTKDM4ENPSR1KMT2A
SCHEMBL9883333 0.81 GAA (0.51) GAAMAPTKDM4ENPSR1KMT2A
Hydrochloric Acid SCHEMBL28695724 0.79 GAA (0.49) GAAMAPTKDM4ENPSR1KMT2A
SCHEMBL13696709 0.79 GAA (0.52) GAAMAPTKDM4ENPSR1KMT2A
SCHEMBL10826850 0.78 GAA (0.47) GAAMAPTKDM4ENPSR1KMT2A
Hydrochloric Acid SCHEMBL31578753 0.78 GAA (0.50) GAAMAPTKDM4ENPSR1KMT2A
SCHEMBL21816341 0.78 GAA (0.47) GAAMAPTKDM4ENPSR1KMT2A
SCHEMBL3930237 0.78 GAA (0.47) GAAMAPTKDM4ENPSR1KMT2A
SCHEMBL3930232 0.78 GAA (0.47) GAAMAPTKDM4ENPSR1KMT2A
SCHEMBL10826852 0.78 GAA (0.47) GAAMAPTKDM4ENPSR1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2654777-A2 METHODS AND COMPOSITIONS SUITABLE FOR MANAGING BLOOD GLUCOSE IN ANIMALS Nestec S.A. (CH) 2013-10-30 EP claimed
WO-2012087742-A2 METHODS AND COMPOSITIONS SUITABLE FOR MANAGING BLOOD GLUCOSE IN ANIMALS NESTEC S.A. (CH) 2012-06-28 WO claimed
US-20150259566-A1 METHODS FOR PROVIDING A LOW GLOSS POLYURETHANE COATING ON A SUBSTRATE BAYER MATERIALSCIENCE LLC (US) 2015-09-17 US disclosed
WO-2015138227-A1 METHODS FOR PROVIDING A LOW GLOSS POLYURETHANE COATING ON A SUBSTRATE BAYER MATERIALSCIENCE LLC (US) 2015-09-17 WO disclosed
US-8178516-B2 Composition of 4-guanidinobenzoic acid HCl, a co-agent suitable for systemic administration solely via the oral route, antioxidants, vitamins, metabolites Sylvan Labs, LLC (US) 2012-05-15 US disclosed
US-20080234380-A1 Compositions and method for treatment of chronic inflammatory diseases SHAPIRO HOWARD K 2008-09-25 US disclosed
CN-1293061-C Novel branched substituted amino derivatives of 3-amino-1-phenyl-1H- [1,2,4] triazole, process for their preparation and pharmaceutical compositions containing them SANOFI SYNTHELABO (FR) 2007-01-03 CN disclosed
US-20050090553-A1 Compositions and method for treatment of chronic inflammatory diseases SECANT PHARMA, LLC 2005-04-28 US disclosed
US-6806282-B2 HAVE AN ANTAGONISTIC ACTIVITY WITH RESPECT TO CORTICOTROPIN RELEASING FACTOR SANOFI-SYNTHELABO (FR) 2004-10-19 US disclosed
US-6746678-B1 Method of treating neurological diseases and etiologically related symptomology using carbonyl trapping agents in combination with medicaments SECANT PHARMA, LLC 2004-06-08 US disclosed
EP-1242389-B1 NOVEL BRANCHED SUBSTITUTED AMINO DERIVATIVES OF 3-AMINO-1-PHENYL-1H[1,2,4]TRIAZOL, METHODS FOR PRODUCING THEM AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SANOFI SYNTHELABO (FR) 2004-04-21 EP disclosed
EP-0604641-B1 USE OF A COMBINATION CONTAINING AN AMINE OR AMINE-RELATED DERIVATIVE OF BENZOIC ACID AND AN AMINO-POLYSACCHARIDE IN THE MANUFACTURE OF A MEDICAMENT FOR THE TREATMENT OF INFLAMMATORY DISEASES SHAPIRO HOWARD K (US) 2002-03-20 EP disclosed
WO-2001044207-A2 NOVEL BRANCHED SUBSTITUTED AMINO DERIVATIVES OF 3-AMINO-1-PHENYL-1H[1,2,4]TRIAZOL, METHODS FOR PRODUCING THEM AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SANOFI-SYNTHELABO (FR) 2001-06-21 WO disclosed
CN-1065480-C Multilayer article comprising a vulcanized elastomer directly bonded to a thermoplastic ATOCHEM ELF SA (FR) 2001-05-09 CN disclosed
CN-1119425-A Multilayer article including a vulcanised elastomer directly combined with a thermoplastic ATOCHEM ELF SA (FR) 1996-03-27 CN disclosed
EP-0604641-A4 COMPOSITION CONTAINING AMINE AND AMINE-RELATED DERIVATIVES OF BENZOIC ACID AND USES THEREFOR INCLUDING TREATING INFLAMMATORY DISEASES. SHAPIRO HOWARD K (US) 1995-08-02 EP disclosed
EP-0572560-A4 USE OF PHARMACEUTICAL COMPOUNDS IN THE TREATMENT OF SYMPTOMS OF DISORDERS RELATED TO NEUROLOGICAL DISEASES AND ETIOLOGICALLY RELATED SYMPTOMOLOGY. SHAPIRO HOWARD K (US) 1995-04-26 EP disclosed
EP-0604641-A1 COMPOSITION CONTAINING AMINE AND AMINE-RELATED DERIVATIVES OF BENZOIC ACID AND USES THEREFOR INCLUDING TREATING INFLAMMATORY DISEASES SHAPIRO, Howard, K. (US) 1994-07-06 EP disclosed
EP-0572560-A1 USE OF PHARMACEUTICAL COMPOUNDS IN THE TREATMENT OF SYMPTOMS OF DISORDERS RELATED TO NEUROLOGICAL DISEASES AND ETIOLOGICALLY RELATED SYMPTOMOLOGY SHAPIRO, Howard, K. (US) 1993-12-08 EP disclosed
WO-1992014456-A1 USE OF PHARMACEUTICAL COMPOUNDS IN THE TREATMENT OF SYMPTOMS OF DISORDERS RELATED TO NEUROLOGICAL DISEASES AND ETIOLOGICALLY RELATED SYMPTOMOLOGY SHAPIRO HOWARD K (US) 1992-09-03 WO 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 (2 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-20050090553-A1 Compositions and method for treatment of chronic inflammatory diseases PCCA, HMGB1, PTGES GAA 1432/4885MAPT 2712/4885KDM4E 2376/4885
US-20080234380-A1 Compositions and method for treatment of chronic inflammatory diseases HMGB1, PCCA, QSOX1 GAA 1423/4885MAPT 3087/4885KDM4E 2124/4885

“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.