SCHEMBL4428331

SCHEMBL4428331

C=CC=C(C=CC#N)C=C(CC)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
SCHEMBL1012458 0.80 PTGS1 (0.31)
SCHEMBL6492591 0.76
SCHEMBL2785101 0.74 CYP3A4 (0.41)
SCHEMBL3464257 0.72 NPC1 (0.43)
SCHEMBL9007457 0.72
SCHEMBL18045171 0.72 ALDH1A1 (0.35)
SCHEMBL1649061 0.72 TSHR (0.35)
SCHEMBL17265275 0.70
SCHEMBL4584135 0.70
SCHEMBL6669152 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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1631621-B1 THERMOPLASTIC RESIN COMPOSITION HAVING IMPROVED EXTERNAL APPEARANCE AND EXCELLENT WEATHERABILITY LG CHEMICAL LTD (KR) 2009-03-11 EP disclosed
EP-1631621-A4 THERMOPLASTIC RESIN COMPOSITION HAVING IMPROVED EXTERNAL APPEARANCE AND EXCELLENT WEATHERABILITY LG CHEMICAL LTD (KR) 2007-04-11 EP disclosed
EP-1631621-A1 THERMOPLASTIC RESIN COMPOSITION HAVING IMPROVED EXTERNAL APPEARANCE AND EXCELLENT WEATHERABILITY LG Chem, Ltd. (KR) 2006-03-08 EP disclosed
WO-2004108823-A1 THERMOPLASTIC RESIN COMPOSITION HAVING IMPROVED EXTERNAL APPEARANCE AND EXCELLENT WEATHERABILITY LG CHEM, LTD. (KR) 2004-12-16 WO disclosed
US-4612131-A Stabilized rubber or lubricant compositions containing mercaptoalkyl esters of hindered phenols CIBA-GEIGY CORPORATION (US) 1986-09-16 US disclosed
US-4532286-A Stabilized rubber or lubricant compositions containing mercaptoalkyl esters of hindered phenols CIBA-GEIGY CORPORATION (US) 1985-07-30 US disclosed
US-4417071-A Phenols useful as stabilizers CIBA-GEIGY CORPORATION (US) 1983-11-22 US disclosed