SCHEMBL3268573

SCHEMBL3268573

CCCCO[Al]OCCCC

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 1/20 0.45
ADRB1 P08588 1/20 0.45
ADRB3 P13945 1/20 0.45
TSHR P16473 6/20 0.39
CYP3A4 P08684 2/20 0.39
LMNA P02545 2/20 0.38
ALDH1A1 P00352 1/20 0.38
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
THRB P10828 1/20 0.35
ATM Q13315 1/20 0.35
LTA4H P09960 2/20 0.34
NR5A1 Q13285 1/20 0.34
SMN1; SMN2 Q16637 3/20 0.32
HPGD P15428 2/20 0.32
ESR1 P03372 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
MAPK1 P28482 1/20 0.31
CYP2C19 P33261 1/20 0.31

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
Iodide SCHEMBL9410962 0.97 ADRB2 (0.43) ADRB2ADRB1ADRB3TSHRCYP3A4
Fluoride SCHEMBL9410959 0.97 ADRB2 (0.43) ADRB2ADRB1ADRB3TSHRCYP3A4
Bromide SCHEMBL9410940 0.97 ADRB2 (0.43) ADRB2ADRB1ADRB3TSHRCYP3A4
Hydrochloric Acid SCHEMBL1359753 0.97 ADRB2 (0.43) ADRB2ADRB1ADRB3TSHRCYP3A4
SCHEMBL6895599 0.94 ADRB2 (0.41) ADRB2ADRB1ADRB3TSHRCYP3A4
Lithium Ion SCHEMBL16685162 0.94 ADRB2 (0.41) ADRB2ADRB1ADRB3TSHRCYP3A4
SCHEMBL9789462 0.94 ADRB2 (0.41) ADRB2ADRB1ADRB3TSHRCYP3A4
SCHEMBL7188812 0.90 THRB (0.41) TSHRCA1CA2THRBNR5A1
Acetone SCHEMBL27840890 0.87 ALDH1A1 (0.52) ADRB2ADRB1ADRB3TSHRCYP3A4
SCHEMBL10501543 0.83 ADRB2 (0.33) ADRB2ADRB1ADRB3TSHRCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114502629-B Safety tyre 株式会社普利司通 2024-12-24 CN disclosed
CN-118725623-A Active energy ray-curable composition, active energy ray-curable composition set product, cured product, and laminate 荒川化学工业株式会社 2024-10-01 CN disclosed
CN-113903997-B Electrolyte, electrochemical device, secondary battery, and assembly 大金工业株式会社 2024-08-30 CN disclosed
US-11773287-B2 Method for forming coating TOKYO OHKA KOGYO CO., LTD. (JP) 2023-10-03 US disclosed
CN-111247681-B Electrolyte, electrochemical device, lithium ion secondary battery and assembly 大金工业株式会社 2023-07-14 CN disclosed
CN-116154292-A Electrolyte, electrochemical device, lithium ion secondary battery and assembly 大金工业株式会社 2023-05-23 CN disclosed
CN-111344891-B Nonaqueous electrolyte and energy device using same 三菱化学株式会社 2023-05-02 CN disclosed
CN-110540687-B Rubber composition for tire and pneumatic tire 住友橡胶工业株式会社 2023-03-10 CN disclosed
CN-111492000-B Rubber composition and tire using same 株式会社普利司通 2023-02-17 CN disclosed
CN-115305004-A Normal temperature curing type hard coating composition 信越化学工业株式会社 2022-11-08 CN disclosed
US-20100298120-A1 PHOTOCATALYST FILM, PROCESS FOR PRODUCING PHOTOCATALYST FILM, ARTICLE AND METHOD FOR HYDROPHILIZATION UBE NITTO KASEI CO., LTD. (JP) 2010-11-25 US disclosed
EP-2202000-A1 PHOTOCATALYTIC FILM, METHOD FOR PRODUCTION OF PHOTOCATALYTIC FILM, ARTICLE, AND HYDROPHILIZATION METHOD UBE Nitto Kasei Co., Ltd. (JP) 2010-06-30 EP disclosed
US-7488524-B2 High-durability photocatalyst film and structure having photocatalytic functions on surface UBE NITTO KASEI CO., LTD. (JP) 2009-02-10 US disclosed
US-20060162617-A1 Photocatalyst coating liquid, photocatalyst film and photocatalyst member UBE NITTO KASEI CO., LTD. (JP) 2006-07-27 US disclosed
US-20050249943-A1 High durabel photocatalyst film and structure having surface exhibiting photocatalytic function UBE NITTO KASEI CO., LTD. (JP) 2005-11-10 US disclosed
EP-1544269-A1 PHOTOCATALYST COATING LIQUID, PHOTOCATALYST FILM AND PHOTOCATALYST MEMBER Ube Nitto Kasei Co., Ltd. (JP) 2005-06-22 EP disclosed
EP-1543949-A1 HIGH DURABLE PHOTOCATALYST FILM AND STRUCTURE HAVING SURFACE EXHIBITING PHOTOCATALYTIC FUNCTION Ube Nitto Kasei Co., Ltd. (JP) 2005-06-22 EP disclosed
US-6737145-B1 Organic-inorganic composite graded material, method for preparation thereof and use thereof UBE NITTO KASEI CO., LTD. (JP) 2004-05-18 US disclosed
EP-1174470-A1 ORGANIC-INORGANIC COMPOSITE GRADED MATERIAL, METHOD FOR PREPARATION THEREOF AND USE THEREOF Ube Nitto Kasei Co., Ltd. (JP) 2002-01-23 EP disclosed
EP-0240333-A2 Thermosetting resin compositions Toray Silicone Company, Ltd. (JP) 1987-10-07 EP disclosed