SCHEMBL4063408

SCHEMBL4063408

C=C(C)C(=O)OC(C)COCCC

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.50
TSHR P16473 3/20 0.44
HSD17B10 Q99714 1/20 0.44
THRB P10828 1/20 0.42
ALDH1A1 P00352 1/20 0.34
PLA2G2C Q5R387 2/20 0.31
USP2 O75604 1/20 0.30

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
SCHEMBL4815158 0.95 TDP1 (0.54) TDP1TSHRHSD17B10THRBALDH1A1
SCHEMBL11240653 0.95 TDP1 (0.54) TDP1TSHRHSD17B10THRBALDH1A1
SCHEMBL11252889 0.95 TDP1 (0.54) TDP1TSHRHSD17B10THRBALDH1A1
SCHEMBL1029759 0.91 TSHR (0.48) TDP1TSHRHSD17B10THRBALDH1A1
SCHEMBL7191777 0.90 TSHR (0.46) TDP1TSHRTHRBALDH1A1PLA2G2C
SCHEMBL27660620 0.87 TSHR (0.56) TSHRPLA2G2CUSP2
SCHEMBL15302991 0.87 TSHR (0.56) TSHRPLA2G2CUSP2
SCHEMBL2219398 0.87 TSHR (0.52) TDP1TSHRTHRBALDH1A1
SCHEMBL5984326 0.86 TSHR (0.44) TDP1TSHRTHRBALDH1A1
SCHEMBL27707717 0.86 TSHR (0.44) TDP1TSHRTHRBALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11859055-B2 Polysiloxane monomer and method for producing same SHIN-ETSU CHEMICAL CO., LTD. (JP) 2024-01-02 US disclosed
US-20210238363-A1 POLYSILOXANE MONOMER AND METHOD FOR PRODUCING SAME SHIN-ETSU CHEMICAL CO., LTD. (JP) 2021-08-05 US disclosed
EP-3805276-A1 POLYSILOXANE MONOMER AND METHOD FOR PRODUCING SAME SHIN-ETSU CHEMICAL CO., LTD. (JP) 2021-04-14 EP disclosed
US-9780374-B2 Binder for electrodes of lithium secondary batteries, and lithium secondary battery which uses electrode produced using binder for electrodes of lithium secondary batteries DAI-ICHI KOGYO SEIYAKU CO., LTD. (JP) 2017-10-03 US disclosed
US-20160362375-A1 Iodine(III)-Mediated Radiofluorination THE GENERAL HOSPITAL CORPORATION 2016-12-15 US disclosed
WO-2009158302-A2 VISCOUS ALPHA-CYANOACRYLATE COMPOSITIONS CLOSURE MEDICAL CORPORATION (US) 2009-12-30 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 (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-20160362375-A1 Iodine(III)-Mediated Radiofluorination TPO, FLI1, SSTR3 TDP1 1940/4885TSHR 24/4885HSD17B10 2634/4885

“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.