SCHEMBL2935905

SCHEMBL2935905

CCCCCCCCC12OC1O2

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.44
THRB P10828 1/20 0.44
ALDH1A1 P00352 3/20 0.37
DNM1 Q05193 7/20 0.36
LMNA P02545 2/20 0.35
HSD17B10 Q99714 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
SLC22A1 O15245 1/20 0.35

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
SCHEMBL8671830 1.00 TSHR (0.44) TSHRTHRBALDH1A1DNM1LMNA
SCHEMBL8743277 1.00 TSHR (0.44) TSHRTHRBALDH1A1DNM1LMNA
SCHEMBL18632072 1.00 TSHR (0.44) TSHRTHRBALDH1A1DNM1LMNA
SCHEMBL8743092 1.00 TSHR (0.44) TSHRTHRBALDH1A1DNM1LMNA
SCHEMBL11580672 0.83 TSHR (0.61) TSHRALDH1A1
SCHEMBL23854647 0.67 TSHR (1.00) TSHRTHRBALDH1A1DNM1LMNA
Hexadecane SCHEMBL23499901 0.67 TSHR (1.00) TSHRTHRBALDH1A1DNM1LMNA
SCHEMBL11854960 0.67 TSHR (1.00) TSHRTHRBALDH1A1DNM1LMNA
Decane SCHEMBL23499900 0.67 TSHR (1.00) TSHRTHRBALDH1A1DNM1LMNA
Decane SCHEMBL170135 0.67 TSHR (1.00) TSHRTHRBALDH1A1DNM1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6762019-B2 Use in activated slides for making microarrays of nucleic acids; monomers with pendant epoxy groups to immobilize biological targets, diluent monomers or polymers, and monomers having a photoreactive group to surface treat the substrate SURMODICS, INC. 2004-07-13 US claimed
CN-115485316-A Polyol block copolymers 艾柯尼克技术有限公司 2022-12-16 CN disclosed
CN-115485317-A Method for preparing polyol block copolymer 艾柯尼克技术有限公司 2022-12-16 CN disclosed
CN-114933890-A Composition for heat cycle system and heat cycle system AGC株式会社 2022-08-23 CN disclosed
US-10399925-B2 Beta-hydroxylated tertiary diamines, a process for their synthesis and their use for eliminating acid compounds a gaseous effluent IFP Energies Nouvelles (FR) 2019-09-03 US disclosed
CN-106478948-B Polyimidazole as bile acid sequestrant 瑞立普萨公司 2019-05-07 CN disclosed
EP-3452028-A1 COMPOSITIONS FOR AND METHOD OF TREATING ACID-BASE DISORDERS Tricida Inc. (US) 2019-03-13 EP disclosed
US-20180251421-A1 NOVEL BETA-HYDROXYLATED TERTIARY DIAMINES, A PROCESS FOR THEIR SYNTHESIS AND THEIR USE FOR ELIMINATING ACID COMPOUNDS A GASEOUS EFFLUENT IFP Energies Nouvelles (FR) 2018-09-06 US disclosed
WO-2017193064-A1 COMPOSITIONS FOR AND METHOD OF TREATING ACID-BASE DISORDERS TRICIDA, INC. (US) 2017-11-09 WO disclosed
US-20170081275-A1 NOVEL BETA-HYDROXYLATED TERTIARY DIAMINES, A PROCESS FOR THEIR SYNTHESIS AND THEIR USE FOR ELIMINATING ACID COMPOUNDS A GASEOUS EFFLUENT IFP ENERGIES NOW (FR) 2017-03-23 US disclosed
US-20030113792-A1 Epoxide polymer surfaces SURMODICS IVD, INC. 2003-06-19 US disclosed
EP-1263991-A2 EPOXIDE POLYMER SURFACES Surmodics Inc. (US) 2002-12-11 EP disclosed
EP-1242546-A1 FILM FORMING COMPOSITIONS CONTAINING OCTYL BENZOATE VELSICOL CHEMICAL CORPORATION (US) 2002-09-25 EP disclosed
US-6419987-B1 COATING A POLYESTER WEB WITH PHOTOSENSITIVE IMAGE EMULSION EASTMAN KODAK COMPANY 2002-07-16 US disclosed
US-6395459-B1 CURING; WATERPROOF PROTECTIVE COATING EASTMAN KODAK COMPANY 2002-05-28 US disclosed
EP-1193551-A2 A method of forming a protective overcoat for imaged elements and related articles EASTMAN KODAK COMPANY (US) 2002-04-03 EP disclosed
WO-2001067129-A2 EPOXIDE POLYMER SURFACES SURMODICS, INC. (US) 2001-09-13 WO disclosed
EP-1111452-A2 Method for providing a high viscosity coating on a moving web and articles made thereby EASTMAN KODAK COMPANY (US) 2001-06-27 EP disclosed
WO-2001029140-A1 FILM FORMING COMPOSITION CONTAINING OCTYL BENZOATE VELSICOL CHEMICAL CORPORATION (US) 2001-04-26 WO disclosed
EP-0610600-A1 Synthesis of diols, for use as intermediates for polymeric materials, by starting from terminal diolefins ENICHEM S.p.A. (IT) 1994-08-17 EP 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-20180251421-A1 NOVEL BETA-HYDROXYLATED TERTIARY DIAMINES, A PROCESS FOR THEIR SYNTHESIS AND THEIR USE FOR ELIMINATING ACID COMPOUNDS A GASEOUS EFFLUENT AOC1, DHODH, DDAH1 TSHR 3425/4885THRB 2317/4885ALDH1A1 13/4885
US-10399925-B2 Beta-hydroxylated tertiary diamines, a process for their synthesis and their use for eliminating acid compounds a gaseous effluent AOC1, DHODH, DDAH1 TSHR 3479/4885THRB 2120/4885ALDH1A1 15/4885
US-20170081275-A1 NOVEL BETA-HYDROXYLATED TERTIARY DIAMINES, A PROCESS FOR THEIR SYNTHESIS AND THEIR USE FOR ELIMINATING ACID COMPOUNDS A GASEOUS EFFLUENT AOC1, DHODH, DDAH1 TSHR 3416/4885THRB 2304/4885ALDH1A1 12/4885

“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.