SCHEMBL377160

SCHEMBL377160

C=CCc1cc2ccccc2s1

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 4/20 0.58
ASIC3 Q9UHC3 1/20 0.58
LOXL2 Q9Y4K0 1/20 0.58
AGXT P21549 1/20 0.53
ADRB2 P07550 1/20 0.53
ADRA1D P25100 2/20 0.44
MGLL Q99685 1/20 0.40
IDH1 O75874 1/20 0.39
CHRNA7 P36544 1/20 0.39
BCL2L1 Q07817 1/20 0.39
CA2 P00918 1/20 0.38

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
SCHEMBL30416943 1.00 CYP2A6 (0.58) CYP2A6ASIC3LOXL2AGXTADRB2
SCHEMBL6533566 0.89 CYP2A6 (0.47) CYP2A6ASIC3LOXL2AGXTADRB2
SCHEMBL12741 0.81 CYP2A6 (0.58) CYP2A6ASIC3LOXL2AGXTADRB2
SCHEMBL8053051 0.81 CYP2A6 (0.58) CYP2A6ASIC3LOXL2AGXTADRB2
SCHEMBL21574689 0.78 CYP2A6 (0.55) CYP2A6ASIC3LOXL2AGXTADRB2
SCHEMBL4883365 0.78 CYP2A6 (0.59) CYP2A6ASIC3LOXL2AGXTADRB2
SCHEMBL27542201 0.78 CYP2A6 (0.59) CYP2A6ASIC3LOXL2AGXTADRB2
SCHEMBL291668 0.78 CYP2A6 (0.70) CYP2A6ASIC3LOXL2AGXTADRB2
SCHEMBL3113989 0.78 CYP2A6 (0.64) CYP2A6ASIC3LOXL2AGXTADRB2
SCHEMBL4961407 0.77 CYP2A6 (0.69) CYP2A6ASIC3LOXL2AGXTADRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117567232-A Extraction separation method of alkyl benzothiophene in beta-methylnaphthalene 中煤科工清洁能源股份有限公司 2024-02-20 CN claimed
CN-116408099-A Adsorption desulfurization catalyst and preparation method and application thereof 中国石油天然气股份有限公司 2023-07-11 CN claimed
CN-116408094-A Adsorption desulfurization catalyst and preparation method and application thereof 中国石油天然气股份有限公司 2023-07-11 CN claimed
CN-116408042-A Desulfurizing adsorbent, and preparation method and application thereof 中国石油天然气股份有限公司 2023-07-11 CN claimed
CN-116408043-A Desulfurizing adsorbent, and preparation method and application thereof 中国石油天然气股份有限公司 2023-07-11 CN claimed
CN-116408104-A Adsorption desulfurization catalyst and preparation method and application thereof 中国石油天然气股份有限公司 2023-07-11 CN claimed
CN-114231315-B Method for preparing second-generation biodiesel by coupling cutting, rectifying, desulfurizing, refining and hydrodesulfurization of crude biodiesel 中国科学院广州能源研究所 2023-02-28 CN claimed
CN-114231315-A Method for preparing second-generation biodiesel by coupling cutting, rectifying, desulfurizing, refining and hydrodesulfurization of crude biodiesel 中国科学院广州能源研究所 2022-03-25 CN claimed
CN-108530466-A A kind of polycyclic aromatic hydrocarbon organic semiconducting materials and its preparation method and application 南京邮电大学 2018-09-14 CN claimed
US-9862895-B2 Method for desulfurizing diesel fuel KING FAHD UNIVERSITY OF PETROLEUM AND MINERALS (SA) 2018-01-09 US claimed
EP-0725126-B1 Process for desulfurizing catalytically cracked gasoline NIPPON MITSUBISHI OIL CORP (JP) 2000-08-09 EP claimed
US-6096750-A Furopyrimidines and methods of making and using the same derivatives DUQUESNE UNIVERSITY OF THE HOLY GHOST (US) 2000-08-01 US claimed
US-6077844-A FOR TREATING ILLNESSES SUCH AS CANCER, AND SECONDARY INFECTIONS CAUSED BY PNEUMOCYSTIS CARINII AND TOXOPLASMOSIS GONDII IN IMMUNOCOMPROMISED PATIENTS DUQUESNE UNIVERSITY OF THE HOLY GHOST (US) 2000-06-20 US claimed
US-5925560-A CONTACTING ORGANIC SULFUR COMPOUNDS WITH PAENIBACILLUS; EFFICIENT CLEAVAGE OF C-S BONDS; POLLUTION CONTROL BY REMOVING SULFUR FROM PETROLEUM AND COAL PETROLEUM ENERGY CENTER (JP) 1999-07-20 US claimed
US-5866580-A TREATING AN ILLNESS CAUSED BY P. CARINII AND T. GONDII DUGUESNE UNIVERSITY OF THE HOLY GHOST (US) 1999-02-02 US claimed
US-5863920-A ANTICARCINOGENIC AGENTS AND BACTERICIDES DUQUESNE UNIVERSITY OF THE HOLY GHOST (US) 1999-01-26 US claimed
US-5736547-A RESISTS PNEUMOCYSTIS CARNII AND TOXOPLASMOSIS GONDII INFECTIONS IN IMMUNOCOMPROMISED PATIENTS; DIHYDROFOLATE REDUCTASE INHIBITORS; AIDS; ANTITUMOR AGENTS; SYNERGISTIC AGENT WITH SULFA DRUGS DUQUESNE UNIVERSITY OF THE HOLY GHOST (US) 1998-04-07 US claimed
EP-0821982-A2 High-Temperature Desulfurization by Microorganisms Petroleum Energy Center (JP) 1998-02-04 EP claimed
EP-0725126-A1 Process for desulfurizing catalytically cracked gasoline MITSUBISHI OIL CO., LTD. (JP) 1996-08-07 EP claimed
US-5508281-A TREATING ILLNESS CAUSED BY PNEUMOCYSTIS CARINII OR TOXOPLASMOSIS GONDII DUQUESNE UNIVERSITY OF THE HOLY GHOST (US) 1996-04-16 US claimed