SCHEMBL2240396

SCHEMBL2240396

C=CC(=O)OCCCCCCOc1ccc(C=O)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.58
TSHR P16473 5/20 0.58
CYP3A4 P08684 1/20 0.58
THRB P10828 1/20 0.56
HTT P42858 3/20 0.49
HPGD P15428 2/20 0.49
LMNA P02545 1/20 0.49
MAPT P10636 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
KMT2A Q03164 1/20 0.44
POLB P06746 1/20 0.43
APEX1 P27695 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
GAA P10253 1/20 0.42
PPARA Q07869 1/20 0.42
ALB P02768 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.41
TP53 P04637 2/20 0.41
HIF1A Q16665 2/20 0.41
HSD17B10 Q99714 1/20 0.41

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
SCHEMBL18347622 1.00 ALDH1A1 (0.58) ALDH1A1TSHRCYP3A4THRBHTT
SCHEMBL12933664 1.00 ALDH1A1 (0.58) ALDH1A1TSHRCYP3A4THRBHTT
SCHEMBL27412820 1.00 ALDH1A1 (0.58) ALDH1A1TSHRCYP3A4THRBHTT
SCHEMBL27407741 1.00 ALDH1A1 (0.58) ALDH1A1TSHRCYP3A4THRBHTT
SCHEMBL2241350 0.98 THRB (0.58) ALDH1A1TSHRCYP3A4THRBHTT
SCHEMBL7706628 0.96 ALDH1A1 (0.53) ALDH1A1TSHRCYP3A4THRBHTT
SCHEMBL8075514 0.96 ALDH1A1 (0.53) ALDH1A1TSHRCYP3A4THRBHTT
SCHEMBL7777481 0.95 THRB (0.58) ALDH1A1TSHRCYP3A4THRBHTT
SCHEMBL12675893 0.94 THRB (0.54) ALDH1A1TSHRCYP3A4THRBHTT
SCHEMBL21908330 0.92 HTT (0.49) ALDH1A1TSHRCYP3A4THRBHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2857424-B1 POLYMERIZABLE COMPOUND, POLYMERIZABLE COMPOSITION, POLYMER, AND OPTICALLY ANISOTROPIC MATERIAL ZEON CORP (JP) 2017-12-27 EP disclosed
US-20170349539-A1 POLYMERIZABLE COMPOUND, POLYMERIZABLE COMPOSITION, POLYMER, AND OPTICALLY ANISOTROPIC SUBSTANCE ZEON CORPORATION (JP) 2017-12-07 US disclosed
US-9776954-B2 Polymerizable compound, polymerizable composition, polymer, and optically anisotropic substance ZEON CORPORATION (JP) 2017-10-03 US disclosed
US-9777096-B2 Polymerizable compound, polymerizable composition, polymer, and optical anisotropic body ZEON CORPORATION (JP) 2017-10-03 US disclosed
US-9586917-B2 Polymerizable compound, polymerizable composition, polymer, optically anisotropic body, and method for producing polymerizable compound ZEON CORPORATION (JP) 2017-03-07 US disclosed
US-20170044279-A1 POLYMERIZABLE COMPOUND, POLYMERIZABLE COMPOSITION, POLYMER, AND OPTICALLY ANISOTROPIC MATERIAL ZEON CORPORATION (JP) 2017-02-16 US disclosed
US-9512251-B2 Polymerizable compound, polymerizable composition, polymer, and optically anisotropic material ZEON CORPORATION (JP) 2016-12-06 US disclosed
US-9475991-B2 Polymerizable liquid crystal composition, polarized light-emitting coating material, novel naphtholactam derivative novel coumarin derivative, novel nile red derivative, and novel anthracene derivative ADEKA CORPORATION (JP) 2016-10-25 US disclosed
US-20160280672-A1 POLYMERIZABLE COMPOUND, POLYMERIZABLE COMPOSITION, POLYMER, OPTICALLY ANISOTROPIC BODY, AND METHOD FOR PRODUCING POLYMERIZABLE COMPOUND ZEON CORPORATION (JP) 2016-09-29 US disclosed
EP-2727904-B1 POLYMERIZABLE COMPOUNDS, POLYMERIZABLE COMPOSITION, POLYMER, AND OPTICALLY ANISOTROPIC BODY ZEON CORP (JP) 2016-08-10 EP disclosed
US-5994033-A GRAFT POLYMER SERICOL LIMITED (GB) 1999-11-30 US disclosed
EP-0885408-A1 A SCREEN PRINTING STENCIL SERICOL LIMITED (GB) 1998-12-23 EP disclosed
WO-1997033202-A1 A SCREEN PRINTING STENCIL SERICOL LIMITED (GB) 1997-09-12 WO disclosed
CN-1129245-A Photopolymerizable liquid crystals HOFFMANN LA ROCHE (CH) 1996-08-21 CN disclosed
CN-1110984-A Photo-cross-linkable liquid crystals HOFFMANN LA ROCHE (CH) 1995-11-01 CN disclosed
EP-0536200-B1 FLUORINE-CONTAINING ACRYLATE AND METHACRYLATE SIDE-CHAIN LIQUID CRYSTAL MONOMERS AND POLYMERS MINNESOTA MINING & MFG (US) 1995-10-11 EP disclosed
US-5408009-A Used in electrooptical devices FUJI PHOTO FILM CO., LTD. (JP) 1995-04-18 US disclosed
EP-0536200-A1 FLUORINE-CONTAINING ACRYLATE AND METHACRYLATE SIDE-CHAIN LIQUID CRYSTAL MONOMERS AND POLYMERS. MINNESOTA MINING & MFG (US) 1993-04-14 EP disclosed
US-5087672-A Lower birefringence and viscosity, increased hydrophobicity MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1992-02-11 US disclosed
WO-1991019773-A1 FLUORINE-CONTAINING ACRYLATE AND METHACRYLATE SIDE-CHAIN LIQUID CRYSTAL MONOMERS AND POLYMERS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1991-12-26 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20160280672-A1 POLYMERIZABLE COMPOUND, POLYMERIZABLE COMPOSITION, POLYMER, OPTICALLY ANISOTROPIC BODY, AND METHOD FOR PRODUCING POLYMERIZABLE COMPOUND PYM1, C5, C1S ALDH1A1 987/4885TSHR 4533/4885CYP3A4 382/4885
US-20170044279-A1 POLYMERIZABLE COMPOUND, POLYMERIZABLE COMPOSITION, POLYMER, AND OPTICALLY ANISOTROPIC MATERIAL ZYX, H1-3, PYM1 ALDH1A1 3419/4885TSHR 4337/4885CYP3A4 2380/4885
US-20170349539-A1 POLYMERIZABLE COMPOUND, POLYMERIZABLE COMPOSITION, POLYMER, AND OPTICALLY ANISOTROPIC SUBSTANCE PYM1, CCNB2, CCNT1 ALDH1A1 1453/4885TSHR 4869/4885CYP3A4 1141/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.