SCHEMBL5698996

SCHEMBL5698996

CC(O)c1ccc[nH]1

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
SCHEMBL5756561 0.81 KDM5A (0.33)
SCHEMBL10366551 0.79 DAO (0.37)
SCHEMBL75926 0.79
SCHEMBL456256 0.79 DAO (0.32)
SCHEMBL4409393 0.79
SCHEMBL23079299 0.75
SCHEMBL4700498 0.75
SCHEMBL4581201 0.75
SCHEMBL25423722 0.75
SCHEMBL13754484 0.75 DAO (0.30)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1664027-A1 SUBSTITUTED 2,3-DIHYDRO-1H-ISOINDOL-1-ONE DERIVATIVES AND METHODS OF USE AMGEN INC. (US) 2006-06-07 EP claimed
EP-1519921-A2 SUBSTITUTED ANTHRANILIC AMIDE DERIVATIVES AND METHODS OF USE Amgen Inc. (US) 2005-04-06 EP claimed
WO-2005021532-A1 SUBSTITUTED 2,3-DIHYDRO-1H-ISOINDOL-1-ONE DERIVATIVES AND METHODS OF USE AMGEN INC (US) 2005-03-10 WO claimed
WO-2004005279-A2 SUBSTITUTED ANTHRANILIC AMIDE DERIVATIVES AND METHODS OF USE AMGEN INC. (US) 2004-01-15 WO claimed
EP-1358184-A1 SUBSTITUTED ALKYLAMINE DERIVATIVES AND METHODS OF USE Amgen Inc. (US) 2003-11-05 EP claimed
WO-2002066470-A1 SUBSTITUTED ALKYLAMINE DERIVATIVES AND METHODS OF USE AMGEN INC. (US) 2002-08-29 WO claimed
US-4911746-A Containing a phenyl ring and an imidazole or a 1,2,4-triazole ring BAYER AKTIENGESELLSCHAFT (DE) 1990-03-27 US claimed
US-4904298-A PLANT GROWTH REGULATORS, FUNGICIDES BAYER AKTIENGESELLSCHAFT (DE) 1990-02-27 US claimed
US-4897107-A PLANT GROWTH REGULATORS; FUNGICIDES BAYER AKTIENGESELLSCHAFT (DE) 1990-01-30 US claimed
US-4871390-A PLANT GROWTH REGULATORS, FUNGICIDES BAYER AKTIENGESELLSCHAFT (DE) 1989-10-03 US claimed
US-4870093-A MEDICINAL FUNGICIDES BAYER AKTIENGESELLSCHAFT (DE) 1989-09-26 US claimed
US-4789672-A PLANT GROWTH REGULATORS, FUNGICIDES BAYER AKTIENGESELLSCHAFT (DE) 1988-12-06 US claimed
CN-87104499-A Novel alginic acid esters 1988-04-06 CN claimed
US-4652579-A AZOLE FUNGICIDES BAYER AKTIENGESELLSCHAFT (DE) 1987-03-24 US claimed
EP-0072580-B1 1-HYDROXYETHYL-AZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS PLANT GROWTH REGULATORS AND FUNGICIDES BAYER AG (DE) 1987-02-25 EP claimed
EP-0087148-B1 1-HYDROXYETHYL-AZOL DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS PLANT GROWTH REGULATORS AND FUNGICIDES BAYER AG (DE) 1986-03-19 EP claimed
EP-0040345-B1 1-HYDROXYETHYL-AZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE IN THE REGULATION OF PLANT GROWTH AND AS FUNGICIDES BAYER AG (DE) 1984-07-11 EP claimed
EP-0043419-B1 ANTIMYCOTIC COMPOSITION BAYER AG (DE) 1984-03-14 EP claimed
JP-2167273-A None JP disclosed
EP-0040345-A1 1-Hydroxyethyl-azole derivatives, process for their preparation and their use in the regulation of plant growth and as fungicides BAYER AG (DE) 1981-11-25 EP disclosed