SCHEMBL2509

SCHEMBL2509

O=S(=O)(O)c1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Known targets — ChEMBL curated mechanism

BTKCACNA1CCACNA1DCACNA1FCACNA1SCACNA2D1CACNA2D2DRD2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQHRH1HTR2AP2RY12

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 1.00
SMN1; SMN2 Q16637 1/20 1.00
POLB P06746 1/20 0.62
CYP2D6 P10635 1/20 0.62
HTR6 P50406 1/20 0.58
LMNA P02545 1/20 0.57
ALDH1A1 P00352 4/20 0.55
NT5E P21589 1/20 0.55
TDP1 Q9NUW8 3/20 0.52
CA1 P00915 2/20 0.52
CA2 P00918 2/20 0.52
HSD17B10 Q99714 2/20 0.52
CA12 O43570 1/20 0.52
CA3 P07451 1/20 0.52
CA4 P22748 1/20 0.52
CA6 P23280 1/20 0.52
CA5A P35218 1/20 0.52
CA7 P43166 1/20 0.52
PLA2G7 Q13093 1/20 0.52
CA9 Q16790 1/20 0.52

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
SCHEMBL3409457 1.00 TSHR (1.00) TSHRSMN1; SMN2POLBCYP2D6HTR6
Benzene SCHEMBL9751882 1.00 TSHR (1.00) TSHRSMN1; SMN2POLBCYP2D6HTR6
SCHEMBL1079321 1.00 TSHR (1.00) TSHRSMN1; SMN2POLBCYP2D6HTR6
SCHEMBL30307036 1.00 TSHR (1.00) TSHRSMN1; SMN2POLBCYP2D6HTR6
SCHEMBL597672 1.00 TSHR (1.00) TSHRSMN1; SMN2POLBCYP2D6HTR6
SCHEMBL125188 1.00 TSHR (1.00) TSHRSMN1; SMN2POLBCYP2D6HTR6
SCHEMBL30671620 1.00 TSHR (1.00) TSHRSMN1; SMN2POLBCYP2D6HTR6
SCHEMBL30812783 1.00 TSHR (1.00) TSHRSMN1; SMN2POLBCYP2D6HTR6
SCHEMBL9871011 0.97 TSHR (0.94) TSHRSMN1; SMN2POLBCYP2D6HTR6
Hydrochloric Acid SCHEMBL11436653 0.97 TSHR (0.94) TSHRSMN1; SMN2POLBCYP2D6HTR6

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

Appears in 455457 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118834118-A Preparation method and system of o-phenylphenol 圣奥化学科技有限公司 2024-10-25 CN claimed
WO-2024217493-A1 CRYSTALLINE METHIONINE ADENOSYLTRANSFERASE 2a (MAT2A) INHIBITOR AND USES THEREOF INSILICO MEDICINE IP LIMITED (CN) 2024-10-24 WO claimed
CN-118791516-A Silane chain extender, preparation method and application thereof 山东共聚有机硅技术研究院有限公司 2024-10-18 CN claimed
US-12102630-B2 Crystalline forms and processes of lenvatinib besylate SYNTHON B.V. (NL) 2024-10-01 US claimed
CN-118725339-A Method for extracting lignin in brewer's grains 华南理工大学 2024-10-01 CN claimed
CN-118271603-B Polyaniline nanoparticle and preparation method thereof 广东腐蚀科学与技术创新研究院 2024-09-24 CN claimed
US-12097184-B2 Formulations of psilocin that have enhanced stability Mind Medicine, Inc. (US) 2024-09-24 US claimed
CN-118684575-A Isomelanin hydroxyl acylated product, preparation method and pharmaceutical application thereof 中国医学科学院药物研究所 2024-09-24 CN claimed
CN-118695759-A Solar cell, preparation method thereof, power utilization device and energy storage device 宁德时代新能源科技股份有限公司 2024-09-24 CN claimed
CN-115872998-B Preparation method of sildenafil and intermediate thereof 山东特珐曼药业有限公司 2024-09-20 CN claimed
US-3936429-A Reactive polymer FUJI PHOTO FILM CO., LTD. (JA) 1976-02-03 US claimed
US-3936451-A Process for producing salts of hexamethylenetetramine UNITED STATES PIPE AND FOUNDRY COMPANY (US) 1976-02-03 US claimed
US-3935098-A Adsorbent process for heavy metals NIPPON SODA CO., LTD. (JA) 1976-01-27 US claimed
US-3935129-A ALKALI METAL SILICATE, UREA, GLYCERINE, TRIETHANOLAMINE, ANIONIC AND NONIONIC DETERGENT JABALEE WALTER J 1976-01-27 US claimed
US-3933509-A Photo-polymerizable composition containing an acid salt of an indolinobenzospiropyran FUJI PHOTO FILM CO., LTD. (JA) 1976-01-20 US claimed
US-3933902-A Method for the optical resolution of DL-αphenylglycine ASAHI KASEI KOGYO KABUSHIKI KAISHA (JA) 1976-01-20 US claimed
US-3932166-A Landfill and soil conditioner VIGNOVICH MARTIN 1976-01-13 US claimed
US-3931262-A Hydrophilic and difficultly volatile biocidal triorganotin compounds CIBA-GEIGY CORPORATION (US) 1976-01-06 US claimed
US-3931215-A OPTICAL BRIGHTENERS HOECHST AKTIENGESELLSCHAFT (DT) 1976-01-06 US claimed
US-3931386-A Process for producing drawn or undrawn flame-resistant, anti-fusing cured phenolic continuous filaments NIPPON KYNOL INCORPORATED (JA) 1976-01-06 US claimed