SCHEMBL7262015

SCHEMBL7262015

N=C(N)Nc1cs[c]n1

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL3430424 0.68 NPC1 (0.41)
SCHEMBL11472840 0.67
SCHEMBL7486358 0.61
SCHEMBL11480120 0.61 KMT2A (0.46)
SCHEMBL10985990 0.60 CDK5 (0.36)
SCHEMBL8548510 0.60 GOT1 (0.55)
SCHEMBL17028924 0.60
SCHEMBL2086729 0.60
SCHEMBL3988243 0.60
SCHEMBL742184 0.60

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 18 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6596706-B1 For the treatment of circulatory diseases cerebral diseases DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2003-07-22 US claimed
EP-0367484-B1 Carboxylic acid derivates GLAXO GROUP LTD (GB) 1994-02-16 EP claimed
US-5273984-A Bismuth complex having a carboxylic acid to form a salt of the basic antagonist excluding ranitidine GLAXO GROUP LIMITED (GB) 1993-12-28 US claimed
EP-0275669-B1 USE OF HETEROCYCLIC DERIVATIVES FOR THE MANUFACTURE OF MEDICAMENTS GLAXO GROUP LIMITED (GB) 1992-09-30 EP claimed
EP-0454449-A1 Carboxylic acid derivatives GLAXO GROUP LIMITED (GB) 1991-10-30 EP claimed
EP-0367484-A1 Carboxylic acid derivates GLAXO GROUP LIMITED (GB) 1990-05-09 EP claimed
EP-0275669-A1 Use of heterocyclic derivatives for the manufacture of medicaments GLAXO GROUP LIMITED (GB) 1988-07-27 EP claimed
EP-0367484-B1 Carboxylic acid derivates GLAXO GROUP LTD (GB) 1994-02-16 EP disclosed
US-5273984-A Bismuth complex having a carboxylic acid to form a salt of the basic antagonist excluding ranitidine GLAXO GROUP LIMITED (GB) 1993-12-28 US disclosed
US-5221688-A Gastrointestinal disorders GLAXO GROUP LIMITED (GB) 1993-06-22 US disclosed
EP-0275669-B1 USE OF HETEROCYCLIC DERIVATIVES FOR THE MANUFACTURE OF MEDICAMENTS GLAXO GROUP LIMITED (GB) 1992-09-30 EP disclosed
EP-0454449-A1 Carboxylic acid derivatives GLAXO GROUP LIMITED (GB) 1991-10-30 EP disclosed
EP-0367484-A1 Carboxylic acid derivates GLAXO GROUP LIMITED (GB) 1990-05-09 EP disclosed
EP-0275669-A1 Use of heterocyclic derivatives for the manufacture of medicaments GLAXO GROUP LIMITED (GB) 1988-07-27 EP disclosed
EP-0073971-B1 THIADIAZOLE OXIDES AS GASTRIC ANTISECRETORY AGENTS MERCK & CO. INC. (US) 1986-05-21 EP disclosed
US-4521418-A HISTAMINE H2-ANTAGONISTS SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1985-06-04 US disclosed
US-4521418-A HISTAMINE H2-ANTAGONISTS SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1985-06-04 US disclosed
EP-0074229-A1 Triazole gastric anti-secretory agents PFIZER INC. (US) 1983-03-16 EP disclosed