SCHEMBL7754426

SCHEMBL7754426

CC(CCOP(O)(=S)OCCC(C)CC(C)(C)C)CC(C)(C)C

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
SCHEMBL8461951 0.81 LPAR3 (0.38)
SCHEMBL8858257 0.81 EGFR (0.31)
SCHEMBL10602850 0.77 PPARD (0.32)
SCHEMBL4809515 0.76 CYP3A4 (0.37)
SCHEMBL14859459 0.74 CA12 (0.41)
SCHEMBL679721 0.74 EGFR (0.33)
SCHEMBL7758349 0.73 LMNA (0.48)
SCHEMBL3278006 0.72 EGFR (0.30)
SCHEMBL11777624 0.72 EGFR (0.30)
SCHEMBL5932393 0.71

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2001056933-A2 COMBINED SUPPORTED LIQUID MEMBRANE/STRIP DISPERSION PROCESSES AND EXTRACTANTS COMMODORE SEPARATION TECHNOLOGIES, INC. (US) 2001-08-09 WO claimed
US-6291705-B1 AS EXTRACTANT USEFUL FOR THE REMOVAL AND RECOVERY OF METALS FROM WASTE WATERS AND PROCESS STREAMS COMMODORE SEPARATION TECHNOLOGIES, INC. 2001-09-18 US disclosed
WO-2001056933-A2 COMBINED SUPPORTED LIQUID MEMBRANE/STRIP DISPERSION PROCESSES AND EXTRACTANTS COMMODORE SEPARATION TECHNOLOGIES, INC. (US) 2001-08-09 WO disclosed