SCHEMBL9587727

SCHEMBL9587727

CCOC(=O)c1c(C)n(C)c2ccc(OC(C)=O)cc12

nearest known ligand 0.74

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
POLB P06746 4/20 0.74
HTT P42858 1/20 0.74
CYP1A2 P05177 2/20 0.70
CYP2C19 P33261 2/20 0.70
CYP3A4 P08684 1/20 0.70
CYP2C9 P11712 1/20 0.70
KDM4E B2RXH2 1/20 0.70
LMNA P02545 1/20 0.70
SMN1; SMN2 Q16637 3/20 0.69
HSD17B10 Q99714 1/20 0.69
TP53 P04637 1/20 0.66
HPGD P15428 1/20 0.66
GAA P10253 2/20 0.62
THRB P10828 1/20 0.58
ALDH1A1 P00352 2/20 0.58
KMT2A Q03164 3/20 0.58
MEN1 O00255 1/20 0.58
CYP2D6 P10635 1/20 0.57
TSHR P16473 1/20 0.55

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
SCHEMBL29429164 1.00 POLB (0.74) POLBHTTCYP1A2CYP2C19CYP3A4
SCHEMBL30875172 0.87 SMN1; SMN2 (0.76) POLBCYP1A2CYP2C19CYP3A4CYP2C9
SCHEMBL9557007 0.87 SMN1; SMN2 (0.76) POLBCYP1A2CYP2C19CYP3A4CYP2C9
SCHEMBL12874096 0.84 POLB (0.82) POLBHTTCYP1A2CYP2C19CYP3A4
SCHEMBL1162097 0.83 POLB (0.80) POLBHTTCYP1A2CYP2C19CYP3A4
SCHEMBL22478566 0.82 ALDH1A1 (0.67) POLBCYP1A2CYP2C19CYP3A4CYP2C9
Mecarbinate SCHEMBL29380431 0.81 LMNA (0.72) POLBKDM4ELMNASMN1; SMN2HSD17B10
Mecarbinate SCHEMBL2109102 0.81 LMNA (0.72) POLBKDM4ELMNASMN1; SMN2HSD17B10
SCHEMBL31693313 0.80 GAA (0.72) KDM4ELMNAGAAKMT2AMEN1
SCHEMBL31693394 0.80 GAA (0.63) KDM4ELMNASMN1; SMN2HPGDGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117586173-B Preparation method of arbidol 石家庄中硕制药有限公司 2024-07-12 CN claimed
CN-117586173-A Preparation method of arbidol 石家庄中硕制药有限公司 2024-02-23 CN claimed
CN-111269168-B Preparation method of arbidol intermediate 苏州敬业医药化工有限公司 2022-04-01 CN claimed
CN-111533677-A Method for synthesizing arbidol hydrochloride intermediate 大连万福制药有限公司 2020-08-14 CN claimed
CN-111269168-A Preparation method of arbidol intermediate 苏州敬业医药化工有限公司 2020-06-12 CN claimed
US-5198552-A Preparation by bromination, sulfiding, aminomethylation NAUCHNO-ISSLEDOVATELSKY INSTITUT MEDITSINSKOI RADIOLOGII AKADEMII MEDITSINSKIKH NAUK SSSR (RU) 1993-03-30 US claimed
WO-2025203062-A1 INDOLE-BASED SMALL MOLECULE ANTIVIRALS AGAINST SARS-COV-2 COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2025-10-02 WO disclosed
CN-117586173-B Preparation method of arbidol 石家庄中硕制药有限公司 2024-07-12 CN disclosed
CN-117586173-B Preparation method of arbidol 石家庄中硕制药有限公司 2024-07-12 CN disclosed
WO-2024061972-A1 METHODS AND PLATFORM FOR CHEMICAL SYNTHESIS THE UNIVERSITY COURT OF THE UNIVERSITY OF GLASGOW (GB) 2024-03-28 WO disclosed
CN-117586173-A Preparation method of arbidol 石家庄中硕制药有限公司 2024-02-23 CN disclosed
CN-117586173-A Preparation method of arbidol 石家庄中硕制药有限公司 2024-02-23 CN disclosed
CN-111269168-B Preparation method of arbidol intermediate 苏州敬业医药化工有限公司 2022-04-01 CN disclosed
CN-111533677-A Method for synthesizing arbidol hydrochloride intermediate 大连万福制药有限公司 2020-08-14 CN disclosed
CN-111269168-A Preparation method of arbidol intermediate 苏州敬业医药化工有限公司 2020-06-12 CN disclosed
CN-105252857-A Silencing material for electric engineering and preparation method thereof JIANGSU YUHENG ELECTRIC CO LTD 2016-01-20 CN disclosed
US-5198552-A Preparation by bromination, sulfiding, aminomethylation NAUCHNO-ISSLEDOVATELSKY INSTITUT MEDITSINSKOI RADIOLOGII AKADEMII MEDITSINSKIKH NAUK SSSR (RU) 1993-03-30 US disclosed
US-5198552-A Preparation by bromination, sulfiding, aminomethylation NAUCHNO-ISSLEDOVATELSKY INSTITUT MEDITSINSKOI RADIOLOGII AKADEMII MEDITSINSKIKH NAUK SSSR (RU) 1993-03-30 US disclosed