SCHEMBL8935605

SCHEMBL8935605

Cc1cc2c(=O)[nH]cc(C)c2cc1OC1CCN(Cc2ccccc2)CC1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.48
MAOB P27338 1/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
POLB P06746 1/20 0.46
SCN1A P35498 4/20 0.45
SCN8A Q9UQD0 4/20 0.45
ACHE P22303 1/20 0.45
PARP1 P09874 1/20 0.44
DRD2 P14416 1/20 0.43
DRD4 P21917 1/20 0.43
DRD3 P35462 1/20 0.43
GAA P10253 1/20 0.43
OPRK1 P41145 1/20 0.43

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
SCHEMBL8938841 0.92 OPRM1 (0.43) MAOAMAOBSMN1; SMN2SCN1ASCN8A
SCHEMBL8935571 0.91 MAOA (0.52) MAOAMAOBSCN1ASCN8AACHE
SCHEMBL8935590 0.91 MAOB (0.49) MAOAMAOBACHEDRD2DRD4
SCHEMBL8935610 0.89 HRH1 (0.43) MAOAMAOBSMN1; SMN2POLBSCN1A
SCHEMBL8935587 0.88 OPRM1 (0.47) SCN1ASCN8AACHEDRD2DRD4
SCHEMBL8938834 0.86 HRH1 (0.41) MAOAMAOBSCN1ASCN8ADRD2
SCHEMBL8935195 0.85 MAOA (0.61) MAOAMAOBSMN1; SMN2ACHEPARP1
SCHEMBL8935441 0.85 HRH1 (0.41) MAOAMAOBPARP1
SCHEMBL8937945 0.84 ROCK1 (0.56) MAOAMAOBSMN1; SMN2SCN1ASCN8A
SCHEMBL8935595 0.83 HRH1 (0.46) DRD2DRD4DRD3OPRK1

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 2595/4885SMN1; SMN2 1282/4885

“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.