SCHEMBL9859672

SCHEMBL9859672

c1ccc(OC(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SRD5A2 P31213 1/20 0.57
ADRA2A P08913 1/20 0.53
ADRA2B P18089 1/20 0.53
ADRA2C P18825 1/20 0.53
F2 P00734 3/20 0.49
PRSS1 P07477 1/20 0.47
SLC6A4 P31645 1/20 0.44
SCN1A P35498 2/20 0.43
SCN2A Q99250 2/20 0.43
SCN3A Q9NY46 2/20 0.43
TSHR P16473 2/20 0.43
LTA4H P09960 1/20 0.43
IDO1 P14902 3/20 0.41
TDO2 P48775 3/20 0.41
SCN4A P35499 2/20 0.41
DPP4 P27487 2/20 0.39

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
Phenol SCHEMBL28177364 0.89 SRD5A2 (0.53) SRD5A2ADRA2AADRA2BADRA2CF2
SCHEMBL27950260 0.87 IDO1 (0.60) SRD5A2ADRA2AADRA2BADRA2CF2
SCHEMBL27871817 0.87 SRD5A2 (0.47) SRD5A2ADRA2AADRA2BADRA2CF2
SCHEMBL825031 0.86 SRD5A2 (0.50) SRD5A2ADRA2AADRA2BADRA2CF2
SCHEMBL824952 0.85 SRD5A2 (0.55) SRD5A2ADRA2AADRA2BADRA2CF2
SCHEMBL824943 0.85 SRD5A2 (0.55) SRD5A2ADRA2AADRA2BADRA2CF2
SCHEMBL6269951 0.84 SRD5A2 (0.53) SRD5A2ADRA2AADRA2BADRA2CF2
SCHEMBL11236506 0.84 SRD5A2 (0.53) SRD5A2ADRA2AADRA2BADRA2CF2
SCHEMBL3131759 0.84 CA4 (0.54) SRD5A2F2PRSS1LTA4H
SCHEMBL6268664 0.84 F2 (0.63) SRD5A2ADRA2AADRA2BADRA2CF2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114436781-B Preparation method of substituted phenol compound 安徽觅拓材料科技有限公司 2023-03-24 CN claimed
CN-114436781-A Preparation method of substituted phenol compound 安徽觅拓材料科技有限公司 2022-05-06 CN claimed
CN-114213433-A Process for the preparation of C-3 tetrahydrofuran substituted cephalosporin-siderophore conjugates 重庆医药高等专科学校 2022-03-22 CN claimed
CN-112209900-A Method for preparing 4-cyclohexylmorpholine compound by using lignin model compound 华东师范大学 2021-01-12 CN claimed
CN-114436781-B Preparation method of substituted phenol compound 安徽觅拓材料科技有限公司 2023-03-24 CN disclosed
CN-114213433-B Process for the preparation of C-3 tetrahydrofuran substituted cephalosporin-siderophore conjugates 重庆医药高等专科学校 2023-03-24 CN disclosed
CN-114436781-A Preparation method of substituted phenol compound 安徽觅拓材料科技有限公司 2022-05-06 CN disclosed
CN-114213433-A Process for the preparation of C-3 tetrahydrofuran substituted cephalosporin-siderophore conjugates 重庆医药高等专科学校 2022-03-22 CN disclosed
CN-111620893-B C-3 tetrahydrofuran substituted cephalosporin-siderophore coupling compound and preparation method and application thereof 重庆医药高等专科学校 2021-12-14 CN disclosed
CN-112209900-A Method for preparing 4-cyclohexylmorpholine compound by using lignin model compound 华东师范大学 2021-01-12 CN disclosed
CN-111620893-A C-3 tetrahydrofuran substituted cephalosporin-siderophore coupling compound and preparation method and application thereof 重庆医药高等专科学校 2020-09-04 CN disclosed
EP-0225471-B1 POLYPHENYLENE SULFIDE CONTAINING COVALENTLY BONDED CHLORINE IN A REDUCED AMOUNT AND PROCESS FOR PRODUCING THE SAME Tosoh Corporation (JP) 1991-03-13 EP disclosed
EP-0225471-A1 Polyphenylene sulfide containing covalently bonded chlorine in a reduced amount and process for producing the same Tosoh Corporation (JP) 1987-06-16 EP disclosed
US-4433156-A Process for preparing fluoran derivatives FUJI PHOTO FILM CO., LTD. (JP) 1984-02-21 US disclosed