SCHEMBL2907389

SCHEMBL2907389

O=S(=O)(c1cccc2c(O)nccc12)N1CCNCC1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 6/20 0.67
ROCK1 Q13464 5/20 0.67
PRKCE Q02156 3/20 0.67
PRKCD Q05655 3/20 0.67
PRKD1 Q15139 3/20 0.67
PRKX P51817 2/20 0.67
CYP3A4 P08684 5/20 0.64
NFKB1 P19838 3/20 0.64
TSHR P16473 2/20 0.64
THPO P40225 1/20 0.64
HIF1A Q16665 1/20 0.64
LMNA P02545 3/20 0.63
MAPT P10636 2/20 0.63
BLM P54132 1/20 0.63
CYP1A2 P05177 3/20 0.60
PRKACA P17612 3/20 0.60
PRKACG P22612 3/20 0.60
PRKACB P22694 3/20 0.60
CYP2C19 P33261 2/20 0.60
PRKD3 O94806 2/20 0.60

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
Hydroxyfasudil SCHEMBL30309462 0.95 ROCK2 (0.75) ROCK2ROCK1PRKCEPRKCDPRKD1
Hydroxyfasudil SCHEMBL29473349 0.95 ROCK2 (0.75) ROCK2ROCK1PRKCEPRKCDPRKD1
Hydroxyfasudil SCHEMBL1827528 0.95 ROCK2 (0.75) ROCK2ROCK1PRKCEPRKCDPRKD1
Hydroxyfasudil SCHEMBL1845381 0.94 ROCK2 (0.73) ROCK2ROCK1PRKCEPRKCDPRKD1
Hydroxyfasudil SCHEMBL30198128 0.94 ROCK2 (0.73) ROCK2ROCK1PRKCEPRKCDPRKD1
Hydroxyfasudil SCHEMBL31717522 0.93 ROCK2 (0.72) ROCK2ROCK1PRKCEPRKCDPRKD1
SCHEMBL8813547 0.88 ROCK2 (0.53) ROCK2ROCK1PRKCEPRKCDPRKD1
SCHEMBL9617966 0.86 SMN1; SMN2 (0.67) ROCK2ROCK1PRKCEPRKCDPRKD1
SCHEMBL2908180 0.84 ROCK2 (0.67) ROCK2ROCK1PRKCEPRKCDPRKD1
SCHEMBL2907238 0.84 POLB (0.56) ROCK2ROCK1PRKCEPRKCDPRKD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1479386-A1 Use of isoquinoline-derivatives for treating and preventing pigmentary disorders Switch Biotech Aktiengesellschaft (DE) 2004-11-24 EP claimed
EP-0956865-B2 MEDICINES COMPRISING Rho KINASE INHIBITOR MITSUBISHI TANABE PHARMA CORP (JP) 2010-08-18 EP disclosed
US-20090036465-A1 COMBINATION THERAPY FOR PULMONARY ARTERIAL HYPERTENSION UNITED THERAPEUTICS CORPORATION 2009-02-05 US disclosed
CN-100389828-C Pharmaceutical preparation containing Rho kinase inhibitor YOSHITOMI PHARMACEUTICAL (JP) 2008-05-28 CN disclosed
WO-2008049000-A2 COMBINATION THERAPY FOR PULMONARY ARTERIAL HYPERTENSION UNITED THERAPEUTICS CORPORATION (US) 2008-04-24 WO disclosed
EP-0956865-B1 MEDICINES COMPRISING Rho KINASE INHIBITOR MITSUBISHI PHARMA CORP (JP) 2007-04-18 EP disclosed
US-6906061-B2 Pharmaceutical agent containing Rho kinase inhibitor MITSUBISHI PHARMA CORPORATION (JP) 2005-06-14 US disclosed
EP-1479386-A1 Use of isoquinoline-derivatives for treating and preventing pigmentary disorders Switch Biotech Aktiengesellschaft (DE) 2004-11-24 EP disclosed
WO-2004062666-A2 USE OF RHO-KINASE INHIBITORRS FOR TREATMENT OF BENIGN PROSTATIC HYPERPLASIA UNIVERSITY COLLEGE LONDON (GB) 2004-07-29 WO disclosed
US-20030134775-A1 Pharmaceutical agent containing Rho kinase inhibitor UEHATA MASAYOSHI (JP) 2003-07-17 US disclosed
EP-0956865-A1 MEDICINES COMPRISING Rho KINASE INHIBITOR YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1999-11-17 EP disclosed
CN-1233188-A Medicines comprising Rho kinase inhibitor YOSHITOMI PHARMACEUTICAL (JP) 1999-10-27 CN disclosed
EP-0618796-B1 ALLEVIATING OR PREVENTION OF MIGRAINE HEADACHE ONSET WITH MAST CELL DEGRANULATION BLOCKING AGENTS KOS PHARMA INC (US) 1999-05-06 EP disclosed
US-5747507-A MYOCARDIAL DISEASE ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1998-05-05 US disclosed
US-5648355-A MAST CELL DEGRANULATION-BLOCK AGENTS KOS PHARMACEUTICAL, INC. (US) 1997-07-15 US disclosed
EP-0654266-A1 CARDIAC PROTECTIVE Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1995-05-24 EP disclosed
US-5250529-A Administering during prodrome phase in absence of analgesic KOS PHARMACEUTICALS, INC. (US) 1993-10-05 US disclosed
EP-0187371-B1 SUBSTITUTED ISOQUINOLINESULFONYL COMPOUNDS Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1991-06-19 EP disclosed
US-4678783-A CARDIOVASCULAR DISORDERS, HYPOTENSIVES, ARTERIOSCLEROSIS ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1987-07-07 US disclosed
EP-0187371-A2 Substituted isoquinolinesulfonyl compounds Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1986-07-16 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030134775-A1 Pharmaceutical agent containing Rho kinase inhibitor ROCK1, RHOA, ARHGDIA ROCK2 4/4885ROCK1 1/4885PRKCE 257/4885
US-20090036465-A1 COMBINATION THERAPY FOR PULMONARY ARTERIAL HYPERTENSION ROCK1, ROCK2, RHOA ROCK2 2/4885ROCK1 1/4885PRKCE 170/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.