SCHEMBL1556670

SCHEMBL1556670

C=CCC1(N)C2CC3CC1CC(O)(C3)C2

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 2/20 0.33
PKM P14618 1/20 0.32

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
SCHEMBL9985728 0.93 HSD11B1 (0.34) HSD11B1
SCHEMBL17338022 0.77 ALDH1A1 (0.32)
SCHEMBL24760895 0.76 PKM (0.35) HSD11B1PKM
SCHEMBL12765556 0.75 GRIN2D (0.39) HSD11B1PKM
SCHEMBL9985135 0.74 PTGS2 (0.39) HSD11B1
SCHEMBL1557250 0.73 HSD11B1 (0.35) HSD11B1PKM
SCHEMBL719792 0.72 ALDH1A1 (0.39)
SCHEMBL5514094 0.71 ALDH1A1 (0.38)
SCHEMBL2264953 0.69 PKM (0.39) HSD11B1PKM
SCHEMBL16374917 0.69 PKM (0.39) HSD11B1PKM

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-2303845-B1 Bi-and polycyclic substituted isoquinoline and isoquinoline derivatives as rho kinase inhibitors SANOFI SA (FR) 2013-09-18 EP disclosed
US-8524737-B2 Bi- and polycyclic substituted isoquinoline and isoquinolinone derivatives SANOFI (FR) 2013-09-03 US disclosed
US-8524737-B2 Bi- and polycyclic substituted isoquinoline and isoquinolinone derivatives SANOFI (FR) 2013-09-03 US disclosed
US-8524737-B2 Bi- and polycyclic substituted isoquinoline and isoquinolinone derivatives SANOFI (FR) 2013-09-03 US disclosed
US-20110190340-A1 BI- AND POLYCYCLIC SUBSTITUTED ISOQUINOLINE AND ISOQUINOLINONE DERIVATIVES SANOFI-AVENTIS (FR) 2011-08-04 US disclosed
US-20110190340-A1 BI- AND POLYCYCLIC SUBSTITUTED ISOQUINOLINE AND ISOQUINOLINONE DERIVATIVES SANOFI-AVENTIS (FR) 2011-08-04 US disclosed
EP-2303845-A2 BI-AND POLYCYCLIC SUBSTITUTED ISOQUINOLINE AND ISOQUINOLINE DERIVATIVES AS RHO KINASE INHIBITORS Sanofi-Aventis (FR) 2011-04-06 EP disclosed
WO-2009156092-A2 BI- AND POLYCYCLIC SUBSTITUTED ISOQUINOLINE AND ISOQUINOLINONE DERIVATIVES SANOFI-AVENTIS (FR) 2009-12-30 WO 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-20110190340-A1 BI- AND POLYCYCLIC SUBSTITUTED ISOQUINOLINE AND ISOQUINOLINONE DERIVATIVES RHOT2, MYLK2, ROCK2 HSD11B1 2886/4885PKM 1551/4885

“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.