SCHEMBL4464368

SCHEMBL4464368

C=CC(=O)c1ccc(C(C)(C)C)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.61
KMT2A Q03164 2/20 0.61
ALDH1A1 P00352 1/20 0.61
HTT P42858 1/20 0.61
HIF1A Q16665 1/20 0.61
THRB P10828 8/20 0.59
THRA P10827 6/20 0.59
ALDH5A1 P51649 1/20 0.57
ABAT P80404 1/20 0.57
AKT1 P31749 1/20 0.54
HDAC1 Q13547 1/20 0.53
SRD5A2 P31213 1/20 0.52
NPC1 O15118 2/20 0.47
MAPT P10636 2/20 0.47
RAB9A P51151 2/20 0.47
POLB P06746 1/20 0.47
RARB P10826 1/20 0.47
RARG P13631 1/20 0.47
TP53 P04637 1/20 0.46
NFKB1 P19838 1/20 0.46

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
Methane SCHEMBL27575376 0.98 MEN1 (0.59) MEN1KMT2AALDH1A1HTTHIF1A
SCHEMBL11295866 0.88 THRB (0.59) MEN1KMT2AALDH1A1HTTHIF1A
SCHEMBL11076540 0.83 ALDH1A1 (0.66) MEN1KMT2AALDH1A1HTTHIF1A
SCHEMBL4256312 0.82 ALDH5A1 (0.80) MEN1KMT2AALDH1A1HTTTHRB
SCHEMBL14400012 0.81 THRB (0.57) MEN1KMT2AALDH1A1HTTHIF1A
SCHEMBL16254875 0.81 THRB (0.57) MEN1KMT2AALDH1A1HTTHIF1A
SCHEMBL1483303 0.81 ALDH1A1 (0.63) MEN1KMT2AALDH1A1HTTHIF1A
SCHEMBL1350180 0.79 CES2 (0.59) THRBTHRAALDH5A1ABATAKT1
SCHEMBL28873661 0.78 ALDH1A1 (0.59) MEN1KMT2AALDH1A1HTTHIF1A
SCHEMBL26676883 0.78 THRB (0.58) MEN1KMT2AALDH1A1HTTHIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1742993-B1 RUBBER COMPOSITION AND TIRE COMPRISING SAME MICHELIN & CIE (FR) 2018-07-04 EP claimed
JP-2007532714-A 2007-11-15 JP claimed
EP-1742993-A1 RUBBER COMPOSITION AND TIRE COMPRISING SAME Société de Technologie Michelin (FR) 2007-01-17 EP claimed
WO-2005108480-A1 RUBBER COMPOSITION AND TIRE COMPRISING SAME SOCIETE DE TECHNOLOGIE MICHELIN (FR) 2005-11-17 WO claimed
EP-1742993-B1 RUBBER COMPOSITION AND TIRE COMPRISING SAME MICHELIN & CIE (FR) 2018-07-04 EP disclosed
CN-102858987-B Utilize the method for olefin(e) acid reductase enzyme reduction cinnamylaldehyde derivatives BASF SE (DE) 2015-09-09 CN disclosed
CN-102858987-A Process for the reduction of cinnamaldehyde derivative employing enoate reductases BASF SE 2013-01-02 CN disclosed
US-7528181-B2 Rubber composition and tire comprising same MICHELIN RECHERCHE ET TECHNIQUE, S.A. (CH) 2009-05-05 US disclosed
US-20080003288-A1 Responsive microgel and methods related thereto SUPRATEK PHARMA INC. (CA) 2008-01-03 US disclosed
US-7204997-B2 Responsive microgel and methods related thereto SUPRATEK PHARMA INC. (CA) 2007-04-17 US disclosed
EP-1742993-A1 RUBBER COMPOSITION AND TIRE COMPRISING SAME Société de Technologie Michelin (FR) 2007-01-17 EP disclosed
US-20060258779-A1 Rubber composition and tire comprising same MICHELIN RECHERCHE ET TECHNIQUE S.A. (CH) 2006-11-16 US disclosed
WO-2005108480-A1 RUBBER COMPOSITION AND TIRE COMPRISING SAME SOCIETE DE TECHNOLOGIE MICHELIN (FR) 2005-11-17 WO disclosed
EP-1478403-A1 RESPONSIVE MICROGEL AND METHODS RELATED THERETO SUPRATEK PHARMA, INC. (CA) 2004-11-24 EP disclosed
US-20030152623-A1 Responsive microgel and methods related thereto SUPRATEK PHARMA INC. (CA) 2003-08-14 US disclosed
WO-2003063909-A1 RESPONSIVE MICROGEL AND METHODS RELATED THERETO SUPRATEK PHARMA INC. (US) 2003-08-07 WO disclosed
EP-0910351-A1 PARTICLES COMPRISING AMPHIPHILIC COPOLYMERS, HAVING A CROSS-LINKED SHELL DOMAIN AND AN INTERIOR CORE DOMAIN, USEFUL FOR PHARMACEUTICAL AND OTHER APPLICATIONS G.D. Searle & Co. (US) 1999-04-28 EP disclosed
EP-0907666-A1 PARTICLES COMPRISING AMPHIPHILIC COPOLYMERS, HAVING A CROSS-LINKED SHELL DOMAIN AND AN INTERIOR CORE DOMAIN, USEFUL FOR PHARMACEUTICAL AND OTHER APPLICATIONS G.D. Searle & Co. (US) 1999-04-14 EP disclosed
WO-1997049736-A2 PARTICLES COMPRISING AMPHIPHILIC COPOLYMERS, HAVING A CROSS-LINKED SHELL DOMAIN AND AN INTERIOR CORE DOMAIN, USEFUL FOR PHARMACEUTICAL AND OTHER APPLICATIONS G.D. SEARLE AND CO. (US) 1997-12-31 WO disclosed
WO-1997049387-A1 PARTICLES COMPRISING AMPHIPHILIC COPOLYMERS, HAVING A CROSS-LINKED SHELL DOMAIN AND AN INTERIOR CORE DOMAIN, USEFUL FOR PHARMACEUTICAL AND OTHER APPLICATIONS G.D. SEARLE AND CO. (US) 1997-12-31 WO disclosed