SCHEMBL2176223

SCHEMBL2176223

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

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.67
TP53 P04637 1/20 0.67
SRD5A2 P31213 4/20 0.64
RARB P10826 1/20 0.57
RARG P13631 1/20 0.57
CA1 P00915 2/20 0.55
CA2 P00918 2/20 0.55
CA12 O43570 1/20 0.55
CA3 P07451 1/20 0.55
TYR P14679 1/20 0.55
DRD1 P21728 1/20 0.55
CA4 P22748 1/20 0.55
CA6 P23280 1/20 0.55
CA5A P35218 1/20 0.55
CA7 P43166 1/20 0.55
CA9 Q16790 1/20 0.55
CA14 Q9ULX7 1/20 0.55
CA5B Q9Y2D0 1/20 0.55
EPHX2 P34913 2/20 0.53
NR1H4 Q96RI1 2/20 0.53

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
SCHEMBL18896444 0.93 TSHR (0.59) TSHRTP53SRD5A2RARBRARG
SCHEMBL20721895 0.93 TSHR (0.59) TSHRTP53SRD5A2RARBRARG
SCHEMBL16772180 0.93 RXRA (0.62) TSHRTP53SRD5A2RARBRARG
SCHEMBL18364476 0.89 SRD5A2 (0.53) TSHRTP53SRD5A2RARBRARG
SCHEMBL23861614 0.85 CA12 (0.64) TSHRTP53SRD5A2RARBRARG
SCHEMBL12195256 0.85 ALDH1A1 (0.76) TSHRTP53SRD5A2RARBRARG
SCHEMBL36693 0.84 SRD5A2 (0.87) TSHRTP53SRD5A2RARBRARG
Ammonia Solution, Strong SCHEMBL3842685 0.82 SRD5A2 (0.83) TSHRTP53SRD5A2RARBRARG
SCHEMBL592353 0.82 SRD5A2 (0.83) TSHRTP53SRD5A2RARBRARG
Methane SCHEMBL10959139 0.82 SRD5A2 (0.83) TSHRTP53SRD5A2RARBRARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240350363-A1 PORTABLE TEMPERATURE CONTROLLED BAG WITH SECURELY MOUNTED UNPOWERED COOLING DEVICE UNITED STATES GOVERNMENT 2024-10-24 US claimed
EP-4397399-A2 MEMBRANES COMPRISING A LAYER OF METAL ORGANIC FRAMEWORK PARTICLES G2O Water Technologies Limited (GB) 2024-07-10 EP claimed
CN-116082646-B Dynamic cross-linked polyether amide elastomer and preparation method thereof 万华化学集团股份有限公司 2024-06-25 CN claimed
CN-114479825-B Dye/metal-organic framework composite material for anti-counterfeiting and information encryption and preparation method thereof 浙江大学 2024-04-05 CN claimed
CN-117304528-A Hydrogel film for removing pollutants in water body and detecting fluorescence and preparation method thereof 浙江大学 2023-12-29 CN claimed
CN-115364822-B Preparation method and application of MOFs material 广东美的白色家电技术创新中心有限公司 2023-10-27 CN claimed
US-11697925-B2 Active atmospheric moisture harvester THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-07-11 US claimed
CN-116082646-A Dynamic cross-linked polyether amide elastomer and preparation method thereof 万华化学集团股份有限公司 2023-05-09 CN claimed
CN-115467165-A Automobile interior odor adsorption composite finishing agent and preparation and application thereof 中国第一汽车股份有限公司 2022-12-13 CN claimed
CN-115364822-A Preparation method and application of MOFs material 广东美的白色家电技术创新中心有限公司 2022-11-22 CN claimed
CN-114621924-A Porous carbon sphere nanoenzyme-doped hydrogen bond organic framework shell layer and preparation method thereof 中国科学院长春应用化学研究所 2022-06-14 CN claimed
CN-114479825-A Dye/metal-organic framework composite material for anti-counterfeiting and information encryption and preparation method thereof 浙江大学 2022-05-13 CN claimed
CN-114133581-A Novel Mg-MOFs, preparation method thereof and application thereof in iron ion detection 浙江大学 2022-03-04 CN claimed
US-20210156124-A1 Active Atmospheric Moisture Harvester THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2021-05-27 US claimed
EP-3774001-A1 MEMBRANES COMPRISING A LAYER OF METAL ORGANIC FRAMEWORK PARTICLES G2O Water Technologies Limited (GB) 2021-02-17 EP claimed
EP-2519467-A1 MODULAR BIOCOMPATIBLE MATERIALS FOR MEDICAL DEVICES AND USES THEREOF Colorado State University Research Foundation (US) 2012-11-07 EP claimed
WO-2011082164-A1 MODULAR BIOCOMPATIBLE MATERIALS FOR MEDICAL DEVICES AND USES THEREOF COLORADO STATE UNIVERSITY RESEARCH FOUNDATION (US) 2011-07-07 WO claimed
EP-0730573-B1 IODINATED DERIVATIVES, PREPARATION AND USE THEREOF AS CONTRAST AGENTS IN X-RAY RADIOLOGY GUERBET SA (FR) 1999-06-30 EP claimed
EP-0730573-A1 IODINATED DERIVATIVES, PREPARATION AND USE THEREOF AS CONTRAST AGENTS IN X-RAY RADIOLOGY GUERBET S.A. (FR) 1996-09-11 EP claimed
WO-1996009281-A1 IODINATED DERIVATIVES, PREPARATION AND USE THEREOF AS CONTRAST AGENTS IN X-RAY RADIOLOGY GUERBET S.A. (FR) 1996-03-28 WO claimed