SCHEMBL2422015

SCHEMBL2422015

N#Cc1cccc(-c2cc(NC3CCN(CCO)CC3)c3cnccc3c2)c1

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 9/20 0.49
ROCK1 Q13464 5/20 0.44
GPR6 P46095 2/20 0.40
PRKCZ Q05513 5/20 0.40
PRKD2 Q9BZL6 4/20 0.40
JAK1 P23458 1/20 0.39
JAK3 P52333 1/20 0.39
MET P08581 1/20 0.37

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
SCHEMBL2427707 0.91 ROCK2 (0.49) ROCK2ROCK1GPR6PRKCZPRKD2
SCHEMBL2427691 0.88 ROCK2 (0.48) ROCK2ROCK1GPR6PRKCZPRKD2
SCHEMBL2426257 0.86 IRAK4 (0.43) ROCK2GPR6PRKCZPRKD2
SCHEMBL13087174 0.86 ROCK2 (0.44) ROCK2GPR6PRKCZPRKD2
SCHEMBL2425776 0.86 ROCK2 (0.56) ROCK2ROCK1JAK1JAK3
SCHEMBL2422828 0.86 ROCK2 (0.48) ROCK2ROCK1GPR6PRKCZPRKD2
SCHEMBL2429898 0.85 ROCK2 (0.46) ROCK2ROCK1GPR6PRKCZPRKD2
SCHEMBL12326815 0.84 ROCK2 (0.46) ROCK2ROCK1GPR6PRKCZPRKD2
SCHEMBL2428040 0.84 ROCK2 (0.43) ROCK2GPR6PRKCZPRKD2JAK1
SCHEMBL2426924 0.84 PAX8 (0.44) ROCK2GPR6PRKCZPRKD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2366699-B1 8-SUBSTITUTED ISOQUINOLINE DERIVATIVE AND USE THEREOF ASAHI KASEI PHARMA CORP (JP) 2013-08-07 EP disclosed
US-8299055-B2 8-substituted isoquinoline derivative and the use thereof ASAHI KASEI PHARMA CORPORATION (JP) 2012-10-30 US disclosed
US-8299055-B2 8-substituted isoquinoline derivative and the use thereof ASAHI KASEI PHARMA CORPORATION (JP) 2012-10-30 US disclosed
US-8299055-B2 8-substituted isoquinoline derivative and the use thereof ASAHI KASEI PHARMA CORPORATION (JP) 2012-10-30 US disclosed
EP-2366699-A1 8-SUBSTITUTED ISOQUINOLINE DERIVATIVE AND USE THEREOF Asahi Kasei Pharma Corporation (JP) 2011-09-21 EP disclosed
US-20100261701-A1 8-Substituted isoquinoline derivative and the use thereof ASAHI KASEI PHARMA CORPORATION (JP) 2010-10-14 US disclosed
US-20100261701-A1 8-Substituted isoquinoline derivative and the use thereof ASAHI KASEI PHARMA CORPORATION (JP) 2010-10-14 US disclosed
US-20100261701-A1 8-Substituted isoquinoline derivative and the use thereof ASAHI KASEI PHARMA CORPORATION (JP) 2010-10-14 US 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 (1 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-20100261701-A1 8-Substituted isoquinoline derivative and the use thereof RELA, NFKBIA, NFKB2 ROCK2 1065/4885ROCK1 745/4885GPR6 2528/4885

“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.