SCHEMBL2596293

SCHEMBL2596293

O=C(O)c1ccc(N(c2ccccc2)c2ccc(C(=O)O)cc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.59
DAO P14920 1/20 0.59
NAPRT Q6XQN6 1/20 0.59
TP53 P04637 1/20 0.57
SRD5A2 P31213 2/20 0.56
CES2 O00748 1/20 0.56
CES1 P23141 1/20 0.56
ALDH1A1 P00352 3/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
KDM4E B2RXH2 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2D6 P10635 1/20 0.50
MAPT P10636 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
TRPA1 O75762 1/20 0.50
CA1 P00915 2/20 0.48
CA2 P00918 2/20 0.48

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
SCHEMBL1246652 1.00 TSHR (0.59) TSHRDAONAPRTTP53SRD5A2
Terephthalic Acid SCHEMBL10615446 0.98 TSHR (0.62) TSHRDAONAPRTTP53SRD5A2
SCHEMBL14769783 0.94 EGFR (0.53) TSHRDAONAPRTTP53SRD5A2
SCHEMBL21760526 0.94 EGFR (0.53) TSHRDAONAPRTTP53SRD5A2
Benzoic Acid SCHEMBL21145080 0.93 TSHR (0.70) TSHRDAONAPRTTP53SRD5A2
SCHEMBL22972761 0.93 TSHR (0.67) TSHRDAONAPRTTP53SRD5A2
SCHEMBL2029621 0.93 TSHR (0.67) TSHRDAONAPRTTP53SRD5A2
SCHEMBL17040204 0.93 TSHR (0.67) TSHRDAONAPRTTP53SRD5A2
SCHEMBL21765823 0.92 EGFR (0.56) TSHRDAONAPRTSRD5A2ALDH1A1
SCHEMBL14856712 0.88 HDAC1 (0.50) TSHRDAONAPRTSRD5A2CES2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117126419-B Cobalt metal organic framework crystal material for gas separation and preparation method and application thereof 德州学院 2024-01-02 CN claimed
CN-117126419-A Cobalt metal organic framework crystal material for gas separation and preparation method and application thereof 德州学院 2023-11-28 CN claimed
CN-115746167-B Room-temperature phosphorescent material, and preparation method and application thereof 中国科学院大学 2023-11-14 CN claimed
CN-116813928-A Nitrogen-containing carboxylic acid transition metal macroporous complex and preparation method and application thereof 延安大学 2023-09-29 CN claimed
CN-116333331-A High-stability cage-based metal organic framework material and preparation method and application thereof 福建工程学院 2023-06-27 CN claimed
CN-112876459-B Multi-cation benzimidazole corrosion inhibitor and preparation method thereof 天津市科达斯实业有限公司 2022-04-01 CN claimed
CN-112876459-A Multi-cation benzimidazole corrosion inhibitor and preparation method thereof 李艳艳 2021-06-01 CN claimed
CN-119039586-A Modified aromatic polyoxadiazole film and preparation method and application thereof 烟台泰和新材高分子新材料研究院有限公司 2024-11-29 CN disclosed
CN-119039586-A Modified aromatic polyoxadiazole film and preparation method and application thereof 烟台泰和新材高分子新材料研究院有限公司 2024-11-29 CN disclosed
CN-118085321-B Porous coordination polymer crystal material, preparation method thereof and adsorption removal of SO (sulfur oxide)2Application in (a) 德州学院 2024-06-21 CN disclosed
CN-117487178-B Preparation and application of metal organic framework material 中南大学 2024-05-28 CN disclosed
CN-118085321-A Porous coordination polymer crystal material, preparation method thereof and adsorption removal of SO (sulfur oxide)2Application in (a) 德州学院 2024-05-28 CN disclosed
CN-117683242-A Triphenylamine rare earth MOF electrochromic material, film and preparation method 江西理工大学 2024-03-12 CN disclosed
US-8926733-B2 Polymers, polymer membranes and methods of producing the same AIR PRODUCTS AND CHEMICALS, INC. (US) 2015-01-06 US disclosed
EP-2569081-A1 POLYMERS, POLYMER MEMBRANES AND METHODS OF PRODUCING THE SAME Air Products and Chemicals, Inc. (US) 2013-03-20 EP disclosed
US-20130047844-A1 POLYMERS, POLYMER MEMBRANES AND METHODS OF PRODUCING THE SAME AIR PRODUCTS AND CHEMICALS, INC. (US) 2013-02-28 US disclosed
WO-2011143530-A1 POLYMERS, POLYMER MEMBRANES AND METHODS OF PRODUCING THE SAME AIR PRODUCTS AND CHEMICALS, INC. (US) 2011-11-17 WO disclosed
US-20070148480-A1 Laminate TEIJIN LIMITED (JP) 2007-06-28 US disclosed
EP-1698460-A1 MULTILAYER BODY TEIJIN LIMITED (JP) 2006-09-06 EP disclosed
US-5536866-A Triarylamine-based dinitrile and dicarboxylic acid monomers THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE (US) 1996-07-16 US disclosed