SCHEMBL9966901

SCHEMBL9966901

C=CC(=O)OCCOCCNC(=O)OC(C)(C)C

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.56
ALDH1A1 P00352 4/20 0.56
TP53 P04637 2/20 0.56
HIF1A Q16665 2/20 0.56
HSD17B10 Q99714 1/20 0.56
THRB P10828 1/20 0.48
ADRB2 P07550 1/20 0.43
HTR1A P08908 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
CA12 O43570 3/20 0.43
CA1 P00915 3/20 0.43
CA2 P00918 3/20 0.43
CA9 Q16790 3/20 0.43
MEN1 O00255 1/20 0.41
GAA P10253 1/20 0.41
KMT2A Q03164 1/20 0.41
IDO1 P14902 1/20 0.40
HPGD P15428 1/20 0.40
CYP3A4 P08684 1/20 0.40
MAOA P21397 1/20 0.38

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
SCHEMBL13405231 1.00 TSHR (0.56) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL757089 0.91 TDP1 (0.47) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL23225393 0.86 IDO1 (0.41) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL20075977 0.85 IDO1 (0.43) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL759464 0.85 CA12 (0.55) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL17696336 0.84 TSHR (0.63) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL14102322 0.84 TSHR (0.68) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL22276648 0.84 TDP1 (0.56) ADRB2HTR1ATDP1CA12CA1
SCHEMBL22276641 0.84 TDP1 (0.56) ADRB2HTR1ATDP1CA12CA1
SCHEMBL12885084 0.84 TDP1 (0.56) ADRB2HTR1ATDP1CA12CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025105486-A1 ANTIBODY-PHOTOSENSITIVE SUBSTANCE CONJUGATE 第一三共株式会社 2025-05-22 WO disclosed
US-11072741-B2 Optically anisotropic layer, method for producing the optically anisotropic layer, a laminate, polarizing plate, display device, liquid crystal compound, method for producing the liquid crystal compound, and carboxylic acid compound FUJIFILM CORPORATION (JP) 2021-07-27 US disclosed
EP-3030244-B1 POLYCONJUGATES FOR DELIVERY OF RNAI TRIGGERS TO TUMOR CELLS IN VIVO ARROWHEAD PHARMACEUTICALS INC (US) 2021-04-21 EP disclosed
US-10316316-B2 Compositions for targeted delivery of siRNA Arrowhead Pharmaceuticals, Inc. (US) 2019-06-11 US disclosed
EP-3023495-B1 COMPOSITIONS FOR TARGETED DELIVERY OF SIRNA ARROWHEAD PHARMACEUTICALS INC (US) 2019-05-08 EP disclosed
US-20170349828-A1 POLYMERIZABLE COMPOSITION, FILM, AND HALF MIRROR FOR DISPLAYING PROJECTION IMAGE FUJIFILM CORPORATION (JP) 2017-12-07 US disclosed
US-20170349828-A1 POLYMERIZABLE COMPOSITION, FILM, AND HALF MIRROR FOR DISPLAYING PROJECTION IMAGE FUJIFILM CORPORATION (JP) 2017-12-07 US disclosed
US-9796756-B2 Galactose cluster-pharmacokinetic modulator targeting moiety for siRNA Arrowhead Pharmaceuticals, Inc. (US) 2017-10-24 US disclosed
US-20170204408-A9 Compositions for Targeted Delivery of siRNA SIXTH STREETLENDING PARTNERS, AS THE ADMINISTRATIVE AGENT 2017-07-20 US disclosed
EP-3192800-A1 GALACTOSE CLUSTER-PHARMACOKINETIC MODULATOR TARGETING MOIETY FOR SIRNA Arrowhead Pharmaceuticals, Inc. (US) 2017-07-19 EP disclosed
US-8313772-B2 Compositions for targeted delivery of siRNA Arrowhead Madison Inc. (US) 2012-11-20 US disclosed
US-20120225129-A1 CONJUGATES, PARTICLES, COMPOSITIONS, AND RELATED METHODS CERULEAN PHARMA INC. (US) 2012-09-06 US disclosed
US-20120225129-A1 CONJUGATES, PARTICLES, COMPOSITIONS, AND RELATED METHODS CERULEAN PHARMA INC. (US) 2012-09-06 US disclosed
US-20120172412-A1 In Vivo Polynucleotide Delivery Conjugates Having Enzyme Sensitive Linkages Arrowhead Madison Inc. (US) 2012-07-05 US disclosed
US-20120172412-A1 In Vivo Polynucleotide Delivery Conjugates Having Enzyme Sensitive Linkages Arrowhead Madison Inc. (US) 2012-07-05 US disclosed
WO-2012083046-A2 GALACTOSE CLUSTER-PHARMACOKINETIC MODULATOR TARGETING MOIETY FOR SIRNA ARROWHEAD RESEARCH CORPORATION (US) 2012-06-21 WO disclosed
US-20120157509-A1 GALACTOSE CLUSTER-PHARMACOKINETIC MODULATOR TARGETING MOIETY FOR siRNA ARROWHEAD RESEARCH CORPORATION 2012-06-21 US disclosed
WO-2012024526-A2 CONJUGATES, PARTICLES, COMPOSITIONS, AND RELATED METHODS CERULEAN PHARMA INC. (US) 2012-02-23 WO disclosed
WO-2011104169-A1 COMPOSITIONS FOR TARGETED DELIVERY OF SIRNA F. HOFFMANN-LA ROCHE AG (CH) 2011-09-01 WO disclosed
US-20110207799-A1 Compositions for Targeted Delivery of siRNA ROCHE MADISON INC. (US) 2011-08-25 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 (6 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-20120172412-A1 In Vivo Polynucleotide Delivery Conjugates Having Enzyme Sensitive Linkages RNASE1, PNKP, POLM TSHR 2340/4885ALDH1A1 4396/4885TP53 1975/4885
US-10316316-B2 Compositions for targeted delivery of siRNA PHAX, RNASE1, SNRPE TSHR 2452/4885ALDH1A1 4718/4885TP53 2831/4885
US-20120157509-A1 GALACTOSE CLUSTER-PHARMACOKINETIC MODULATOR TARGETING MOIETY FOR siRNA GALK1, GALE, GALNT6 TSHR 1212/4885ALDH1A1 1838/4885TP53 3555/4885
US-20110207799-A1 Compositions for Targeted Delivery of siRNA PHAX, RNASE1, SNRPE TSHR 2452/4885ALDH1A1 4718/4885TP53 2831/4885
US-20170204408-A9 Compositions for Targeted Delivery of siRNA PHAX, RNASE1, SNRPE TSHR 2452/4885ALDH1A1 4718/4885TP53 2831/4885
US-20120225129-A1 CONJUGATES, PARTICLES, COMPOSITIONS, AND RELATED METHODS SYNCRIP, EXOSC5, EXOSC9 TSHR 2594/4885ALDH1A1 3222/4885TP53 122/4885

“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.