SCHEMBL3366152

SCHEMBL3366152

C=CC[PH](=O)OCCCCC

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.38
ALDH1A1 P00352 1/20 0.36
HPGD P15428 1/20 0.35
CA1 P00915 6/20 0.33
CA2 P00918 6/20 0.33
CA9 Q16790 6/20 0.33
PLA2G2C Q5R387 1/20 0.33
ZDHHC20 Q5W0Z9 1/20 0.33
LPAR1 Q92633 2/20 0.32
LPAR3 Q9UBY5 2/20 0.32
HCAR2 Q8TDS4 1/20 0.32
LPAR2 Q9HBW0 1/20 0.32
NAAA Q02083 1/20 0.32
CA12 O43570 1/20 0.32
CA3 P07451 1/20 0.32
CA4 P22748 1/20 0.32
CA6 P23280 1/20 0.32
CA5A P35218 1/20 0.32
CA7 P43166 1/20 0.32
CA14 Q9ULX7 1/20 0.32

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
SCHEMBL28985816 0.98 TSHR (0.41) TSHRCA1CA2CA9PLA2G2C
SCHEMBL11320138 0.82 TSHR (0.43) TSHRALDH1A1HPGDCA1CA2
SCHEMBL11312201 0.81 TSHR (0.47) TSHRALDH1A1CA1CA2CA9
SCHEMBL9235349 0.80 TSHR (0.35) TSHRALDH1A1HPGDCA1CA2
SCHEMBL3822338 0.78 CA1 (0.38) TSHRHPGDCA1CA2CA9
SCHEMBL3805260 0.78 TSHR (0.34) TSHRHPGDCA1CA2CA9
SCHEMBL28985856 0.76 TSHR (0.35) TSHRHPGDCA1CA2CA9
SCHEMBL28985829 0.76 TSHR (0.35) TSHRHPGDCA1CA2CA9
SCHEMBL1930609 0.76 TSHR (0.41) TSHRALDH1A1HPGDCA1CA2
SCHEMBL28985839 0.76 TSHR (0.35) TSHRHPGDCA1CA2CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100145057-A1 NOVEL PRODRUGS SUN PHARMA ADVANCED RESEARCH COMPANY LTD. (IN) 2010-06-10 US claimed
US-20050165206-A1 Method for producing melt-stable homo- and copolyesters of cyclic esters and/or diesters FRAUNHOFER-GESELLSCHAFT ZUR FORDERUNG DER ANGEWANDTEN FORSCHUNG E.V. (DE) 2005-07-28 US claimed
CN-116390980-A Flame-retardant polybutylene terephthalate resin composition and resin molded article 宝理塑料株式会社 2023-07-04 CN disclosed
US-20210394486-A1 ANTI-BLUSH AND CHEMICAL RESISTANT POLYESTER FILM TORAY PLASTICS AMERICA INC (US) 2021-12-23 US disclosed
US-11110688-B2 Anti-blush and chemical resistant polyester film TORAY PLASTICS (AMERICA), INC. (US) 2021-09-07 US disclosed
US-9169360-B2 Alkyl phosphinate polymer and methods for preparing and using the same SHANGHAI HUIHAI CHEMICAL TECHNOLOGY CO., LTD. (CN) 2015-10-27 US disclosed
US-20150051328-A1 ALKYL PHOSPHINATE POLYMER AND METHODS FOR PREPARING AND USING THE SAME SHANGHAI HUIHAI CHEMICAL TECHNOLOGY CO., LTD. (CN) 2015-02-19 US disclosed
US-20060255494-A1 Polymer composite material and process for producing the same MITSUBISHI CHEMICAL CORPORATION (JP) 2006-11-16 US disclosed
EP-0248681-B1 METHOD OF CLEANING THE INTERIOR OF POLYMERIZATION REACTOR Kanegafuchi Chemical Industry Co., Ltd. (JP) 1992-12-16 EP disclosed
US-3957668-A AIRCRAFT HYDRAULIC FLUID MCDONNELL DOUGLAS CORPORATION (US) 1976-05-18 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-20100145057-A1 NOVEL PRODRUGS UGT2B7, UGT1A1, UGT1A6 TSHR 3135/4885ALDH1A1 221/4885HPGD 250/4885

“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.