SCHEMBL8935808

SCHEMBL8935808

O=c1[nH]ccc2cc(OCC3CCN(Cc4ccc(Cl)cc4)CC3)ccc12

nearest known ligand 0.59

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAOB P27338 9/20 0.59
MAP2K1 Q02750 1/20 0.56
MAOA P21397 8/20 0.49
ACHE P22303 1/20 0.48
CHEK2 O96017 1/20 0.47

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
SCHEMBL8935887 0.93 MAP2K1 (0.55) MAOBMAP2K1MAOAACHE
SCHEMBL8938922 0.91 MAP2K1 (0.55) MAOBMAP2K1MAOAACHECHEK2
SCHEMBL8935814 0.91 MAOA (0.59) MAOBMAP2K1MAOAACHE
SCHEMBL8938927 0.89 MAOB (0.52) MAOBMAP2K1MAOAACHE
SCHEMBL8935917 0.89 MAP2K1 (0.55) MAOBMAP2K1MAOAACHE
SCHEMBL8935883 0.88 MAP2K1 (0.52) MAOBMAP2K1MAOAACHE
SCHEMBL8935983 0.88 MAP2K1 (0.52) MAOBMAP2K1MAOAACHE
SCHEMBL8934763 0.85 ROCK1 (0.60) MAOBMAOA
SCHEMBL8935778 0.85 MAP2K1 (0.53) MAOBMAP2K1MAOAACHE
SCHEMBL8935962 0.85 MAP2K1 (0.49) MAOBMAP2K1MAOAACHE

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 MAOB 2595/4885MAP2K1 1916/4885MAOA 2633/4885

“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.