SCHEMBL19611353

SCHEMBL19611353

CCCCC(CC)COC(=O)CC(C)S

nearest known ligand 0.66

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 5/20 0.66
TSHR P16473 3/20 0.66
TDP1 Q9NUW8 2/20 0.66
ATM Q13315 1/20 0.66
RECQL P46063 1/20 0.62
ALDH1A1 P00352 6/20 0.50
CA2 P00918 4/20 0.50
LMNA P02545 3/20 0.46
MAPK1 P28482 3/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
HSD17B10 Q99714 1/20 0.45
PRSS1 P07477 1/20 0.44
PRSS2 P07478 1/20 0.44
PRSS3 P35030 1/20 0.44
MMP9 P14780 1/20 0.40
MMP8 P22894 1/20 0.40
MMP14 P50281 1/20 0.40
MAPT P10636 1/20 0.39
CA1 P00915 1/20 0.39

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
SCHEMBL2459730 0.87 RECQL (0.67) CYP3A4TSHRTDP1ATMRECQL
SCHEMBL27587426 0.87 CYP3A4 (0.66) CYP3A4TSHRTDP1ATMRECQL
SCHEMBL20368911 0.87 CYP3A4 (0.70) CYP3A4TSHRTDP1ATMRECQL
SCHEMBL28246238 0.86 CYP3A4 (0.74) CYP3A4TSHRTDP1ATMRECQL
SCHEMBL5420740 0.85 CYP3A4 (0.68) CYP3A4TSHRTDP1ATMRECQL
SCHEMBL22091828 0.85 CYP3A4 (0.68) CYP3A4TSHRTDP1ATMRECQL
SCHEMBL5420738 0.85 CYP3A4 (0.68) CYP3A4TSHRTDP1ATMRECQL
SCHEMBL10142335 0.84 RECQL (0.67) CYP3A4TSHRTDP1ATMRECQL
SCHEMBL22091930 0.84 CYP3A4 (0.66) CYP3A4TSHRTDP1ATMRECQL
SCHEMBL21811427 0.84 CYP3A4 (0.66) CYP3A4TSHRTDP1ATMRECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109964540-B Organic EL display device 东丽株式会社 2022-04-01 CN disclosed
CN-108027561-B Negative photosensitive resin composition, cured film, element and display device provided with cured film, and method for producing same 东丽株式会社 2021-10-08 CN disclosed
CN-109964540-A Organic EL display device 东丽株式会社 2019-07-02 CN disclosed
CN-109964327-A Field effect transistor, its manufacturing method, wireless telecom equipment and Commercial goods labels using it 东丽株式会社 2019-07-02 CN disclosed
CN-107428935-B Diamine compound, heat-resistant resin or heat-resistant resin precursor using it 东丽株式会社 2019-04-02 CN disclosed
CN-109328322-A Negative light-sensitive resin combination, cured film, the element for having cured film, the display device and organic el display for having element 东丽株式会社 2019-02-12 CN disclosed
CN-107409457-B Organic EL display device and its manufacturing method 东丽株式会社 2018-11-13 CN disclosed
CN-108027561-A Negative light-sensitive resin combination, cured film, the element for possessing cured film and display device and its manufacture method 东丽株式会社 2018-05-11 CN disclosed
CN-107428935-A Diamine compound, heat-resistant resin or heat-resistant resin precursor using it 东丽株式会社 2017-12-01 CN disclosed
CN-107409457-A Organic EL display and its manufacture method 东丽株式会社 2017-11-28 CN disclosed
US-20170334837-A1 DIAMINE COMPOUND, AND HEAT-RESISTANT RESIN OR HEAT-RESISTANT RESIN PRECURSOR USING SAME TORAY INDUSTRIES, INC. (JP) 2017-11-23 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-20170334837-A1 DIAMINE COMPOUND, AND HEAT-RESISTANT RESIN OR HEAT-RESISTANT RESIN PRECURSOR USING SAME HEATR1, HSF1, RER1 CYP3A4 3653/4885TSHR 4182/4885TDP1 1116/4885

“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.