SCHEMBL12099604

SCHEMBL12099604

C=CC(=O)OCCCCOCC1(CC)COC1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 8/20 0.49
HPGD P15428 1/20 0.49
ALDH1A1 P00352 3/20 0.49
CYP3A4 P08684 1/20 0.49
TP53 P04637 2/20 0.41
HIF1A Q16665 2/20 0.41
HSD17B10 Q99714 1/20 0.41
THRB P10828 1/20 0.39
PRKCA P17252 2/20 0.33
ATM Q13315 1/20 0.33
HCAR2 Q8TDS4 2/20 0.33
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
CTSK P43235 1/20 0.31

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
SCHEMBL12168487 0.99 TSHR (0.51) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL12168484 0.97 TSHR (0.49) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL7879723 0.92 TSHR (0.51) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL26703785 0.90 TSHR (0.54) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL10100422 0.86 TSHR (0.49) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL21385223 0.86 TSHR (0.51) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL384901 0.84 TSHR (0.42) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL14445494 0.82 NPC1 (0.42) TSHRHPGDALDH1A1CYP3A4THRB
SCHEMBL4644870 0.82 ATM (0.39) TSHRHPGDPRKCAATMHCAR2
SCHEMBL13882270 0.81 ALDH1A1 (0.42) TSHRALDH1A1PRKCAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120040723-A Curable composition, cured film, organic EL element, and method for producing same JSR株式会社 2025-05-27 CN disclosed
CN-118146493-A Curable composition, cured film, organic EL element, method for producing the same, and compound JSR株式会社 2024-06-07 CN disclosed
CN-115232511-B Sealing agent for organic EL display element 积水化学工业株式会社 2023-11-24 CN disclosed
US-20230350294-A1 Negative Photosensitive Resin Composition, Patterning Process, Interlayer Insulating Film, Surface Protection Film, And Electronic Component SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-11-02 US disclosed
CN-115232511-A Sealing agent for organic EL display element 积水化学工业株式会社 2022-10-25 CN disclosed
CN-110583098-B Sealing agent for organic EL display element 积水化学工业株式会社 2022-07-26 CN disclosed
CN-110583098-A Sealing agent for organic EL display element 积水化学工业株式会社 2019-12-17 CN disclosed
US-8993790-B2 Oxetane-ring-containing (meth)acrylic acid ester compound DAICEL CORPORATION (JP) 2015-03-31 US disclosed
US-8993790-B2 Oxetane-ring-containing (meth)acrylic acid ester compound DAICEL CORPORATION (JP) 2015-03-31 US disclosed
US-8993790-B2 Oxetane-ring-containing (meth)acrylic acid ester compound DAICEL CORPORATION (JP) 2015-03-31 US disclosed
US-20130035465-A1 RADICAL POLYMERIZABLE RESIN, RADICAL POLYMERIZABLE RESIN COMPOSITION, AND CURED PRODUCT THEREOF DAICEL CORPORATION (JP) 2013-02-07 US disclosed
US-20130035465-A1 RADICAL POLYMERIZABLE RESIN, RADICAL POLYMERIZABLE RESIN COMPOSITION, AND CURED PRODUCT THEREOF DAICEL CORPORATION (JP) 2013-02-07 US disclosed
US-20120309930-A1 CATIONICALLY POLYMERIZABLE RESIN, CATIONICALLY POLYMERIZABLE RESIN COMPOSITION, AND CURED PRODUCTS THEREOF DAICEL CORPORATION (JP) 2012-12-06 US disclosed
US-20120309930-A1 CATIONICALLY POLYMERIZABLE RESIN, CATIONICALLY POLYMERIZABLE RESIN COMPOSITION, AND CURED PRODUCTS THEREOF DAICEL CORPORATION (JP) 2012-12-06 US disclosed
US-20120309930-A1 CATIONICALLY POLYMERIZABLE RESIN, CATIONICALLY POLYMERIZABLE RESIN COMPOSITION, AND CURED PRODUCTS THEREOF DAICEL CORPORATION (JP) 2012-12-06 US disclosed
EP-2502922-A1 OXETANE-RING-CONTAINING (METH)ACRYLIC ACID ESTER COMPOUND Daicel Chemical Industries, Ltd. (JP) 2012-09-26 EP disclosed
EP-2502922-A1 OXETANE-RING-CONTAINING (METH)ACRYLIC ACID ESTER COMPOUND Daicel Chemical Industries, Ltd. (JP) 2012-09-26 EP disclosed
US-20120232295-A1 OXETANE-RING-CONTAINING (METH)ACRYLIC ACID ESTER COMPOUND DAICEL CORPORATION (JP) 2012-09-13 US disclosed
US-20120232295-A1 OXETANE-RING-CONTAINING (METH)ACRYLIC ACID ESTER COMPOUND DAICEL CORPORATION (JP) 2012-09-13 US disclosed
US-20120232295-A1 OXETANE-RING-CONTAINING (METH)ACRYLIC ACID ESTER COMPOUND DAICEL CORPORATION (JP) 2012-09-13 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 (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-20130035465-A1 RADICAL POLYMERIZABLE RESIN, RADICAL POLYMERIZABLE RESIN COMPOSITION, AND CURED PRODUCT THEREOF PTGER1, RAD51, REV1 TSHR 3867/4885HPGD 241/4885ALDH1A1 240/4885
US-20120232295-A1 OXETANE-RING-CONTAINING (METH)ACRYLIC ACID ESTER COMPOUND OXGR1, OXER1, ASS1 TSHR 2458/4885HPGD 341/4885ALDH1A1 46/4885
US-20120309930-A1 CATIONICALLY POLYMERIZABLE RESIN, CATIONICALLY POLYMERIZABLE RESIN COMPOSITION, AND CURED PRODUCTS THEREOF ARG1, ARGLU1, RAD51 TSHR 3119/4885HPGD 685/4885ALDH1A1 1148/4885

“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.