SCHEMBL7259462

SCHEMBL7259462

CC(CO)(CO)C([O])=O

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
Bicarbonate SCHEMBL5494530 0.78 TSHR (0.52)
SCHEMBL26766 0.73
SCHEMBL7640768 0.73
SCHEMBL6595154 0.73
SCHEMBL181160 0.73 TSHR (0.55)
SCHEMBL276567 0.73
Bicarbonate SCHEMBL28022644 0.72 TSHR (0.41)
SCHEMBL10455659 0.71 TSHR (0.52)
SCHEMBL337233 0.71 TSHR (0.52)
SCHEMBL6557046 0.71 TSHR (0.52)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160022648-A1 THERAPEUTIC AGENT FOR MEIBOMIAN GLAND DYSFUNCTION SANTEN PHARMACEUTICAL CO., LTD. (JP) 2016-01-28 US claimed
EP-2974728-A1 THERAPEUTIC AGENT FOR MEIBOMIAN DYSFUNCTION Santen Pharmaceutical Co., Ltd (JP) 2016-01-20 EP claimed
EP-1216251-B1 REGIOSELECTIVE SYNTHESIS OF RAPAMYCIN DERIVATIVES WYETH CORP (US) 2003-02-26 EP claimed
US-11951098-B2 Therapeutic agent for meibomian dysfunction SANTEN PHARMACEUTICAL CO., LTD. (JP) 2024-04-09 US disclosed
US-20230190716-A1 THERAPEUTIC AGENT FOR MEIBOMIAN DYSFUNCTION SANTEN PHARMACEUTICAL CO., LTD. (JP) 2023-06-22 US disclosed
US-11612590-B2 Therapeutic agent for meibomian dysfunction SANTEN PHARMACEUTICAL CO., LTD. (JP) 2023-03-28 US disclosed
EP-3689348-A1 THERAPEUTIC AGENT FOR MEIBOMIAN GLAND DYSFUNCTION Santen Pharmaceutical Co., Ltd. (JP) 2020-08-05 EP disclosed
EP-2974728-B1 THERAPEUTIC AGENT FOR MEIBOMIAN DYSFUNCTION SANTEN PHARMACEUTICAL CO LTD (JP) 2020-05-06 EP disclosed
US-20190255026-A1 THERAPEUTIC AGENT FOR MEIBOMIAN DYSFUNCTION SANTEN PHARMACEUTICAL CO., LTD. (JP) 2019-08-22 US disclosed
US-20180021314-A1 THERAPEUTIC AGENT FOR MEIBOMIAN DYSFUNCTION SANTEN PHARMACEUTICAL CO., LTD. (JP) 2018-01-25 US disclosed
US-20160022648-A1 THERAPEUTIC AGENT FOR MEIBOMIAN GLAND DYSFUNCTION SANTEN PHARMACEUTICAL CO., LTD. (JP) 2016-01-28 US disclosed
EP-2974728-A1 THERAPEUTIC AGENT FOR MEIBOMIAN DYSFUNCTION Santen Pharmaceutical Co., Ltd (JP) 2016-01-20 EP disclosed
EP-2660241-A2 C-17-HETEROARYL STEROIDAL COMPOUNDS AS INHIBITORS OF CYP11B, CYP17, AND/OR CYP21 BioMarin Pharmaceutical Inc. (US) 2013-11-06 EP disclosed
EP-2651916-A2 C-17-HETEROARYL STEROIDAL COMPOUNDS AS INHIBITORS OF CYP11B, CYP17, AND/OR CYP21 BioMarin Pharmaceutical Inc. (US) 2013-10-23 EP disclosed
US-20130252930-A1 CYP11B, CYP17, AND/OR CYP21 INHIBITORS BIOMARIN PHARMACEUTICAL INC. (CA) 2013-09-26 US disclosed
WO-2012083112-A2 CYP11B, CYP17, AND/OR CYP21 INHIBITORS BIOMARIN PHARMACEUTICAL INC. (US) 2012-06-21 WO disclosed
EP-1216251-B1 REGIOSELECTIVE SYNTHESIS OF RAPAMYCIN DERIVATIVES WYETH CORP (US) 2003-02-26 EP disclosed
EP-1216251-A2 REGIOSELECTIVE SYNTHESIS OF RAPAMYCIN DERIVATIVES Wyeth (US) 2002-06-26 EP disclosed
WO-2001023395-A2 REGIOSELECTIVE SYNTHESIS OF RAPAMYCIN DERIVATIVES AMERICAN HOME PRODUCTS CORPORATION (US) 2001-04-05 WO disclosed