SCHEMBL9788012

SCHEMBL9788012

C=CC(=O)OCCCCCCOc1ccc(-c2ccc(OC)cc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.54
ALDH1A1 P00352 1/20 0.54
CYP3A4 P08684 1/20 0.54
THRB P10828 1/20 0.54
HPGD P15428 1/20 0.50
HTT P42858 3/20 0.47
RARB P10826 3/20 0.47
HRH2 P25021 1/20 0.46
HRH1 P35367 1/20 0.46
HDAC3 O15379 4/20 0.46
HDAC4 P56524 4/20 0.46
HDAC1 Q13547 4/20 0.46
HDAC7 Q8WUI4 4/20 0.46
HDAC2 Q92769 4/20 0.46
HDAC10 Q969S8 4/20 0.46
HDAC11 Q96DB2 4/20 0.46
HDAC8 Q9BY41 4/20 0.46
HDAC6 Q9UBN7 4/20 0.46
HDAC9 Q9UKV0 4/20 0.46
HDAC5 Q9UQL6 4/20 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
SCHEMBL18815067 1.00 TSHR (0.54) TSHRALDH1A1CYP3A4THRBHPGD
SCHEMBL14275372 0.99 THRB (0.55) TSHRALDH1A1CYP3A4THRBHPGD
SCHEMBL28940563 0.96 THRB (0.55) TSHRALDH1A1CYP3A4THRBHPGD
SCHEMBL19039556 0.96 TSHR (0.59) TSHRALDH1A1CYP3A4THRBHPGD
SCHEMBL12112436 0.94 THRB (0.59) TSHRALDH1A1CYP3A4THRBHPGD
SCHEMBL12172633 0.93 TSHR (0.63) TSHRALDH1A1CYP3A4THRBHPGD
SCHEMBL14907526 0.93 TSHR (0.63) TSHRALDH1A1CYP3A4THRBHPGD
SCHEMBL723159 0.93 TSHR (0.63) TSHRALDH1A1CYP3A4THRBHPGD
SCHEMBL13289971 0.93 TSHR (0.63) TSHRALDH1A1CYP3A4THRBHPGD
SCHEMBL20312227 0.91 TSHR (0.54) TSHRALDH1A1CYP3A4THRBHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115301082-A Nanoscale microporous filter membrane, preparation method and application thereof 上海先认新材料合伙企业(有限合伙) 2022-11-08 CN claimed
CN-115301082-A Nanoscale microporous filter membrane, preparation method and application thereof 上海先认新材料合伙企业(有限合伙) 2022-11-08 CN disclosed
US-7427363-B2 Composition for forming liquid crystal film, optically anisotropic film, and production method thereof SONY CHEMICAL & INFORMATION DEVICE CORPORATION (JP) 2008-09-23 US disclosed
US-20080049319-A1 POLYMERIZABLE MONOMER, AN OPTICAL COMPENSATION FILM AND A METHOD FOR PRODUCING THE OPTICAL COMPENSATION FILM FUJIFILM CORPORATION (JP) 2008-02-28 US disclosed
US-20080049319-A1 POLYMERIZABLE MONOMER, AN OPTICAL COMPENSATION FILM AND A METHOD FOR PRODUCING THE OPTICAL COMPENSATION FILM FUJIFILM CORPORATION (JP) 2008-02-28 US disclosed
US-20070114491-A1 Composition for forming liquid crystal film, optically anisotropic film, and production method thereof SONY CHEMICALS CORP. (JP) 2007-05-24 US disclosed
US-5043391-A Linear addition polymer with hyperpolarizable side groups AKZO N.V. (NL) 1991-08-27 US disclosed
US-4999401-A Electro-optical Laminates AKZO N.V. (NL) 1991-03-12 US 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 (1 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-20080049319-A1 POLYMERIZABLE MONOMER, AN OPTICAL COMPENSATION FILM AND A METHOD FOR PRODUCING THE OPTICAL COMPENSATION FILM NR2E3, RAD51, RXFP3 TSHR 2525/4885ALDH1A1 2741/4885CYP3A4 2426/4885

“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.