SCHEMBL7825908

SCHEMBL7825908

O=S(=O)=C1N=CCc2ccccc21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 5/20 0.38
CES1 P23141 3/20 0.38
BCHE P06276 2/20 0.35
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MAOB P27338 2/20 0.31
KMT2A Q03164 3/20 0.31
MEN1 O00255 2/20 0.31
CDC25B P30305 1/20 0.31
ALDH1A1 P00352 3/20 0.31
SOAT1 P35610 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2C19 P33261 1/20 0.31
CA12 O43570 1/20 0.31
CA9 Q16790 1/20 0.31
ACHE P22303 1/20 0.31
CYP2A6 P11509 1/20 0.31
KDM4E B2RXH2 1/20 0.30
CES2 O00748 1/20 0.30
APAF1 O14727 1/20 0.30

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
SCHEMBL57213 0.74 CA12 (0.42) MAOACES1BCHEMAOBKMT2A
SCHEMBL29824315 0.74 CA12 (0.42) MAOACES1BCHEMAOBKMT2A
Hydrochloric Acid SCHEMBL7005883 0.72 CA12 (0.41) MAOACES1BCHEMAOBKMT2A
SCHEMBL3099042 0.72 CA12 (0.41) MAOACES1BCHEMAOBKMT2A
Hydrochloric Acid SCHEMBL2455497 0.72 CA12 (0.41) MAOACES1BCHEMAOBKMT2A
SCHEMBL4771824 0.69 MAOA (0.34) MAOACES1BCHEL3MBTL1MAOB
SCHEMBL7614336 0.69 MAOA (0.33) MAOACES1BCHEMAOBKMT2A
SCHEMBL10640017 0.69 ALDH1A1 (0.42) MAOACES1BCHEL3MBTL1KMT2A
SCHEMBL398908 0.65 IDO1 (0.32)
Acetamide SCHEMBL1668160 0.65 ALDH1A1 (0.38) MAOACES1TDP1KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101962379-B Method for refining sulfonyl isoquinoline derivative SHANXI POWERDONE PHARMACEUTICS CO LTD 2013-02-27 CN claimed
EP-1140834-A1 HETEROCYCLIC PIPERIDINES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY Du Pont Pharmaceuticals Company (US) 2001-10-10 EP claimed
WO-2000035877-A1 HETEROCYCLIC PIPERIDINES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY DU PONT PHARMACEUTICALS COMPANY (US) 2000-06-22 WO claimed
EP-0187371-B1 SUBSTITUTED ISOQUINOLINESULFONYL COMPOUNDS Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1991-06-19 EP claimed
JP-7118236-A None JP disclosed
CN-112010805-B Refining method of fasudil hydrochloride 山东威高药业股份有限公司 2023-12-05 CN disclosed
CN-109705096-B Refining method of fasudil hydrochloride 山东新华制药股份有限公司 2023-06-09 CN disclosed
EP-3199161-B1 PHARMACEUTICAL PREPARATION KOWA CO (JP) 2021-12-15 EP disclosed
CN-112010805-A Method for refining fasudil hydrochloride 山东威高药业股份有限公司 2020-12-01 CN disclosed
CN-111803506-A Application of fasudil in preparation of medicine for treating developmental stage white matter injury disease 四川大学华西第二医院 2020-10-23 CN disclosed
CN-109705096-A A kind of refining methd of Fasudic hydrochloride 山东新华制药股份有限公司 2019-05-03 CN disclosed
CN-104098547-B A kind of process for purification of Fasudic hydrochloride 天津红日药业股份有限公司 2016-08-24 CN disclosed
CN-101962379-B Method for refining sulfonyl isoquinoline derivative SHANXI POWERDONE PHARMACEUTICS CO LTD 2013-02-27 CN disclosed
CN-101962379-A Method for refining sulfonyl isoquinoline derivative SHANXI POWERDONE PHARMACEUTICS CO LTD 2011-02-02 CN disclosed
CN-101962379-A Method for refining sulfonyl isoquinoline derivative SHANXI POWERDONE PHARMACEUTICS CO LTD 2011-02-02 CN disclosed
EP-1140834-A1 HETEROCYCLIC PIPERIDINES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY Du Pont Pharmaceuticals Company (US) 2001-10-10 EP disclosed
WO-2000035877-A1 HETEROCYCLIC PIPERIDINES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY DU PONT PHARMACEUTICALS COMPANY (US) 2000-06-22 WO disclosed
JP-H07118236-A SULFONYLISOQUINOLINE DERIVATIVE AND AGRICULTURAL AND HORTICULTURAL GERMICIDE HOKKO CHEM IND CO LTD 1995-05-09 JP disclosed
EP-0187371-B1 SUBSTITUTED ISOQUINOLINESULFONYL COMPOUNDS Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1991-06-19 EP disclosed
EP-0187371-A2 Substituted isoquinolinesulfonyl compounds Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1986-07-16 EP disclosed