SCHEMBL140815

SCHEMBL140815

O=C(O)Cc1ccc2ccccc2n1

nearest known ligand 0.65

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.65
AKR1B1 P15121 2/20 0.55
MGAM O43451 1/20 0.53
KDM4E B2RXH2 2/20 0.53
PRNP P04156 2/20 0.53
RXFP1 Q9HBX9 2/20 0.53
GPBAR1 Q8TDU6 3/20 0.53
CYSLTR1 Q9Y271 5/20 0.52
CYSLTR2 Q9NS75 4/20 0.52
PTGDR2 Q9Y5Y4 1/20 0.52
MEN1 O00255 1/20 0.51
ALDH1A1 P00352 1/20 0.51
KMT2A Q03164 1/20 0.51
FFAR1 O14842 1/20 0.51
MAPK10 P53779 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
KDM4C Q9H3R0 1/20 0.50
CNR2 P34972 1/20 0.49

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
Anthracene SCHEMBL10418177 0.95 CYP1A2 (0.59) CYP1A2AKR1B1MGAMKDM4EPRNP
Acetic Acid SCHEMBL27459479 0.95 CYP1A2 (0.64) CYP1A2AKR1B1MGAMKDM4EPRNP
Sulfuric Acid SCHEMBL28294784 0.93 CYP1A2 (0.58) CYP1A2AKR1B1MGAMKDM4EPRNP
SCHEMBL14805320 0.86 CYP1A2 (0.67) CYP1A2AKR1B1MGAMKDM4EPRNP
SCHEMBL28635312 0.85 CYP1A2 (0.61) CYP1A2AKR1B1MGAMKDM4EPRNP
SCHEMBL28197583 0.84 CYP1A2 (0.59) CYP1A2MGAMKDM4EGPBAR1CYSLTR1
SCHEMBL29450381 0.83 ALDH1A1 (0.51) CYP1A2AKR1B1MGAMKDM4EPRNP
SCHEMBL5503169 0.83 CYP1A2 (0.63) CYP1A2AKR1B1MGAMKDM4EGPBAR1
SCHEMBL4623799 0.83 CYP1A2 (0.68) CYP1A2MGAMKDM4EGPBAR1CYSLTR1
SCHEMBL7759109 0.83 CYP1A2 (0.63) CYP1A2AKR1B1MGAMKDM4EPRNP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115198275-B Sand surface aluminum alloy masking agent and preparation method and application thereof 湖北奥美伦科技有限公司 2024-02-09 CN claimed
CN-117069658-A Preparation method of 4-oxo-6-methoxy-3- (2, 3-dichlorophenyl) methyl-1 (4H) -quinolineacetic acid 宁夏康亚药业股份有限公司 2023-11-17 CN claimed
CN-113372268-B 4-oxo-6-methoxy-3- (2, 3-dichlorophenyl) methyl-1 (4H) quinolineacetic acid metabolites 宁夏康亚药业股份有限公司 2023-10-17 CN claimed
CN-116259723-A Sulfur-carbon compound composite positive electrode material, and preparation and application thereof 中国科学院大连化学物理研究所 2023-06-13 CN claimed
CN-115198275-A Sand surface aluminum alloy masking agent and preparation method and application thereof 湖北奥美伦科技有限公司 2022-10-18 CN claimed
CN-113248421-B Preparation method of nifedipine 合肥立方制药股份有限公司 2022-03-08 CN claimed
CN-113372268-A 4-oxo-6-methoxy-3- (2, 3-dichlorophenyl) methyl-1 (4H) quinolineacetic acid metabolites 宁夏康亚药业股份有限公司 2021-09-10 CN claimed
CN-113248421-A Preparation method of nifedipine 合肥立方制药股份有限公司 2021-08-13 CN claimed
CN-107931891-B Solder paste soldering flux 潮州三环(集团)股份有限公司 2020-08-25 CN claimed
CN-108396325-B Water-soluble weldable nickel protective agent 广州天至环保科技有限公司 2020-07-03 CN claimed
CN-1203430-A Conductive paste, its manufacturing method, and printed wiring board using same MATSUSHITA ELECTRIC INDUSTRIAL CO LTD (JP) 1998-12-30 CN claimed
US-5720897-A A COMPLEXES AS ANTIDEPOSITING AGENT, PRECIPITATION INHIBITOR UNIVERSITY OF FLORIDA (US) 1998-02-24 US claimed
CN-1035873-C Preparation of amides and peptides HOFFMANN LA ROCHE (CH) 1997-09-17 CN claimed
CN-1111237-A Preparation of amides and peptides HOFFMANN LA ROCHE (CH) 1995-11-08 CN claimed
EP-0256181-B1 NOVEL QUINALDINAMIDE DERIVATIVES AND THEIR PREPARATIONS NIPPON CHEMIPHAR CO., LTD. (JP) 1991-01-23 EP claimed
US-4983455-A CORROSION RESISTANCE, SMOOTH RUNNING HITACHI MAXELL, LTD. (JP) 1991-01-08 US claimed
EP-0279381-A2 Magnetic recording medium Hitachi Maxell Ltd. (JP) 1988-08-24 EP claimed
EP-0256181-A1 Novel quinaldinamide derivatives and their preparations NIPPON CHEMIPHAR CO., LTD. (JP) 1988-02-24 EP claimed
EP-0083222-B1 NEW QUINOLYLACETIC ACID COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM NIPPON ZOKI PHARMACEUTICAL CO. LTD. (JP) 1986-02-26 EP claimed
US-4555513-A 1,2 Dihydro- and 1,2,3,4-tetrahydro quinolylacetic acids and analgesic use thereof NIPPON ZOKI PHARMACEUTICAL CO. (JP) 1985-11-26 US claimed