SCHEMBL7434355

SCHEMBL7434355

O=[C]CNC1=CCC=CC1

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
SCHEMBL7494179 0.77
SCHEMBL4719477 0.71 KMT2A (0.33)
Hydrochloric Acid SCHEMBL11878758 0.69 KMT2A (0.32)
SCHEMBL2368471 0.66 CA12 (0.35)
SCHEMBL10895319 0.64
SCHEMBL7435722 0.64 CTSK (0.38)
SCHEMBL6446166 0.64
SCHEMBL9640756 0.63
SCHEMBL4719612 0.62 LMNA (0.36)
SCHEMBL10951106 0.60 LMNA (0.34)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2681224-A1 DEGRADATION OF PENICILLIN COMPOUNDS DSM Sinochem Pharmaceuticals Netherlands B.V. (NL) 2014-01-08 EP claimed
WO-2012117038-A1 DEGRADATION OF PENICILLIN COMPOUNDS DSM SINOCHEM PHARMACEUTICALS NETHERLANDS B.V. (NL) 2012-09-07 WO claimed
EP-2681224-B1 DEGRADATION OF PENICILLIN COMPOUNDS DSM SINOCHEM PHARM NL BV (NL) 2016-06-22 EP disclosed
EP-2681224-A1 DEGRADATION OF PENICILLIN COMPOUNDS DSM Sinochem Pharmaceuticals Netherlands B.V. (NL) 2014-01-08 EP disclosed
WO-2012117038-A1 DEGRADATION OF PENICILLIN COMPOUNDS DSM SINOCHEM PHARMACEUTICALS NETHERLANDS B.V. (NL) 2012-09-07 WO disclosed
EP-0542525-B1 Antithrombotic agents LILLY CO ELI (US) 1998-07-08 EP disclosed
EP-0837071-A1 Tripeptide antithrombotic agents ELI LILLY AND COMPANY (US) 1998-04-22 EP disclosed
EP-0685489-A2 Tripeptide antithrombotic agents ELI LILLY AND COMPANY (US) 1995-12-06 EP disclosed
EP-0684258-A2 Tripeptide antithrombotic agents ELI LILLY AND COMPANY (US) 1995-11-29 EP disclosed
US-5430023-A Tripeptide antithrombotic agents ELI LILLY AND COMPANY (US) 1995-07-04 US disclosed
US-5252566-A Antithrombotic agents ELI LILLY AND COMPANY (US) 1993-10-12 US disclosed
EP-0542525-A2 Antithrombotic agents ELI LILLY AND COMPANY (US) 1993-05-19 EP disclosed
EP-0479489-A2 Tripeptide antithrombotic agents ELI LILLY AND COMPANY (US) 1992-04-08 EP disclosed
US-4683227-A CEPHALOSPORINS ELI LILLY AND COMPANY (US) 1987-07-28 US disclosed
EP-0211526-A2 Cephalosporins, their preparation and formulations ELI LILLY AND COMPANY (US) 1987-02-25 EP disclosed
US-4248868-A FOR TREATING SYSTEMIC INFECTIONS BY GRAMPOSITIVE AND GRAM NEGATIVE BACTERIA CIBA-GEIGY CORPORATION (US) 1981-02-03 US disclosed
US-4182866-A CEPHALOSPORINS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1980-01-08 US disclosed