SCHEMBL1726384

SCHEMBL1726384

CC(C)(C)NC(=O)CCc1ccc(O)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC2 Q92769 1/20 0.57
HDAC8 Q9BY41 1/20 0.57
TSHR P16473 3/20 0.51
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
ESRRB O95718 2/20 0.48
ESRRG P62508 2/20 0.48
KDM4E B2RXH2 2/20 0.47
F13A1 P00488 1/20 0.47
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
GAA P10253 2/20 0.46
HCAR2 Q8TDS4 2/20 0.46
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
ESR1 P03372 2/20 0.45
ESR2 Q92731 1/20 0.45
HPGD P15428 2/20 0.45
CYP19A1 P11511 2/20 0.45

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
SCHEMBL2581112 0.84 TPSAB1 (0.47) HDAC2HDAC8MEN1KMT2ACA1
SCHEMBL12376675 0.84 HDAC2 (0.61) HDAC2HDAC8TSHRMEN1KMT2A
SCHEMBL19891526 0.81 ALDH1A1 (0.63) MEN1KMT2AGAASMN1; SMN2HPGD
SCHEMBL2578755 0.80 HDAC1 (0.48) MEN1KMT2AGAANPC1RAB9A
SCHEMBL13609517 0.79 HDAC2 (0.62) HDAC2HDAC8TSHRMEN1KMT2A
SCHEMBL16290162 0.79 GAA (0.50) HDAC2HDAC8TSHRMEN1KMT2A
SCHEMBL8238392 0.77 HDAC8 (0.89) HDAC2HDAC8ESR1ESR2HDAC1
SCHEMBL14468017 0.76 HDAC2 (0.59) HDAC2HDAC8TSHRMEN1KMT2A
SCHEMBL26188017 0.76 RAB9A (0.58) HDAC2HDAC8CA1CA2NPC1
SCHEMBL8980106 0.76 CYP24A1 (0.51) HDAC2HDAC8TSHRMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0458509-B1 Oxidation-resistant ethylene vinyl alcohol polymer compositions DU PONT (US) 1996-07-17 EP claimed
US-5028347-A Polyamide Resins; Permanent Magnets For Electronic Equipment TONG YANG NYLON CO. LTD. (KR) 1991-07-02 US claimed
WO-2013017528-A1 GREASE COMPOSITION SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) 2013-02-07 WO disclosed
EP-2403657-A1 PROCESS FOR PREPARING STRUCTURED ORGANIC FILMS (SOFS) VIA A PRE-SOF Xerox Corporation (US) 2012-01-11 EP disclosed
CN-101411677-A Cosmetic composition comprising a polyester and a branched hydrocarbon compound OREAL (FR) 2009-04-22 CN disclosed
EP-1769015-A1 SULFONATED AROMATIC COPOLYESTERS CONTAINING HYDROXYALKANOIC ACID GROUPS AND SHAPED ARTICLES PRODUCED THEREFROM E.I.Du pont de nemours and company (US) 2007-04-04 EP disclosed
WO-2006010063-A1 SULFONATED AROMATIC COPOLYESTERS CONTAINING HYDROXYALKANOIC ACID GROUPS AND SHAPED ARTICLES PRODUCED THEREFROM E.I. DUPONT DE NEMOURS AND COMPANY (US) 2006-01-26 WO disclosed
WO-2002079173-A1 BENZOTRIAZOLES AND THEIR USE AS UV LIGHT STABILISERS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2002-10-10 WO disclosed
EP-1086172-A1 THERMOSTABLE SEGMENTED POLYETHERESTER COPOLYMER COMPOSITION DSM N.V. (NL) 2001-03-28 EP disclosed
WO-1999062995-A1 THERMOSTABLE SEGMENTED POLYETHERESTER COPOLYMER COMPOSITION DSM N.V. (NL) 1999-12-09 WO disclosed
EP-0353768-B1 Thermoplastic copolyetherester elastomers DU PONT (US) 1996-01-17 EP disclosed
EP-0353768-A2 Thermoplastic copolyetherester elastomers E.I. DU PONT DE NEMOURS AND COMPANY (US) 1990-02-07 EP disclosed