SCHEMBL8017328

SCHEMBL8017328

O=C(OC(S)S)C(F)(F)F

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
SCHEMBL11412431 0.79 TSHR (0.31)
SCHEMBL449640 0.75
SCHEMBL8883172 0.74
SCHEMBL3399566 0.74 CETP (0.31)
SCHEMBL826905 0.72 TSHR (0.46)
SCHEMBL5312660 0.72 ABHD6 (0.33)
SCHEMBL1738945 0.72
SCHEMBL321296 0.72 TSHR (0.33)
SCHEMBL10412374 0.72 HTT (0.32)
SCHEMBL11183323 0.70

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6111110-A Synthesis of benzo[f]quinolinones ELI LILLY AND COMPANY (US) 2000-08-29 US claimed
WO-1998018757-A1 SYNTHESIS OF BENZO[F]QUINOLINONES ELI LILLY AND COMPANY (US) 1998-05-07 WO claimed
EP-0839807-A1 Synthesis of benzo(f)quinolinones ELI LILLY AND COMPANY (US) 1998-05-06 EP claimed
US-6111110-A Synthesis of benzo[f]quinolinones ELI LILLY AND COMPANY (US) 2000-08-29 US disclosed
EP-0969003-A2 Process for the preparation of benzo[f]quinolinone derivatives and intermediates ELI LILLY AND COMPANY (US) 2000-01-05 EP disclosed
WO-1999065878-A1 SYNTHESIS OF BENZO[F]QUINOLINONES ELI LILLY AND COMPANY (US) 1999-12-23 WO disclosed
WO-1998018757-A1 SYNTHESIS OF BENZO[F]QUINOLINONES ELI LILLY AND COMPANY (US) 1998-05-07 WO disclosed
EP-0839807-A1 Synthesis of benzo(f)quinolinones ELI LILLY AND COMPANY (US) 1998-05-06 EP disclosed