SCHEMBL8935814

SCHEMBL8935814

O=c1[nH]ccc2cc(OCC3CCN(Cc4ccccc4)CC3)ccc12

nearest known ligand 0.67

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOA P21397 3/20 0.59
MAOB P27338 3/20 0.59
ACHE P22303 1/20 0.59
MAP2K1 Q02750 1/20 0.57
PRKACA P17612 3/20 0.50
PRKACG P22612 3/20 0.50
PRKACB P22694 3/20 0.50

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
SCHEMBL8935808 0.91 MAOB (0.59) MAOAMAOBACHEMAP2K1
SCHEMBL8935917 0.90 MAP2K1 (0.55) MAOAMAOBACHEMAP2K1
SCHEMBL8935887 0.90 MAP2K1 (0.55) MAOAMAOBACHEMAP2K1PRKACA
SCHEMBL8938922 0.90 MAP2K1 (0.55) MAOAMAOBACHEMAP2K1
SCHEMBL8936015 0.88 MAP2K1 (0.52) MAOAMAOBACHEMAP2K1PRKACA
SCHEMBL8935778 0.88 MAP2K1 (0.53) MAOAMAOBACHEMAP2K1
SCHEMBL8935883 0.87 MAP2K1 (0.52) MAOAMAOBACHEMAP2K1
SCHEMBL8938927 0.86 MAOB (0.52) MAOAMAOBACHEMAP2K1
SCHEMBL8935983 0.86 MAP2K1 (0.52) MAOAMAOBACHEMAP2K1
SCHEMBL8935934 0.86 MAP2K1 (0.53) MAOAMAOBACHEMAP2K1PRKACA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2385047-B1 Piperidinyl-substituted isoquinolone derivatives SANOFI SA (FR) 2013-05-29 EP disclosed
US-8188117-B2 Piperidinyl-substituted isoquinolone derivatives SANOFI-AVENTIS (FR) 2012-05-29 US disclosed
US-8188117-B2 Piperidinyl-substituted isoquinolone derivatives SANOFI-AVENTIS (FR) 2012-05-29 US disclosed
EP-2385047-A1 Piperidinyl-substituted isoquinolone derivatives SANOFI (FR) 2011-11-09 EP disclosed
US-20090093518-A1 Piperidinyl-substituted isoquinolone derivatives SANOFI-AVENTIS (FR) 2009-04-09 US disclosed
US-20090093518-A1 Piperidinyl-substituted isoquinolone derivatives SANOFI-AVENTIS (FR) 2009-04-09 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-20090093518-A1 Piperidinyl-substituted isoquinolone derivatives MYLK2, MYLK, RHOT2 MAOA 2633/4885MAOB 2595/4885ACHE 3559/4885

“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.