SCHEMBL8936664

SCHEMBL8936664

Cc1c[nH]c(=O)c2ccc(OC3CCN(Cc4ccccc4)CC3)c(F)c12

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.48
MAOA P21397 1/20 0.46
MAOB P27338 1/20 0.46
SCN8A Q9UQD0 7/20 0.45
GAA P10253 1/20 0.43
SCN1A P35498 6/20 0.42
HRH1 P35367 2/20 0.42
CCR3 P51677 2/20 0.42
PARP1 P09874 1/20 0.40
HRH3 Q9Y5N1 1/20 0.40
ACHE P22303 1/20 0.40

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
SCHEMBL8936719 0.92 HRH1 (0.42) SMN1; SMN2MAOAMAOBSCN8ASCN1A
SCHEMBL8936686 0.91 MAOB (0.47) SMN1; SMN2MAOAMAOBSCN8AHRH1
SCHEMBL8936704 0.90 HRH1 (0.45) SMN1; SMN2MAOAMAOBHRH1CCR3
SCHEMBL8936855 0.89 ACHE (0.44) MAOAMAOBSCN8ASCN1ACCR3
SCHEMBL8936649 0.89 HRH1 (0.41) SCN8ASCN1AHRH1CCR3ACHE
SCHEMBL8936820 0.89 ADRB2 (0.43) SMN1; SMN2MAOAMAOBHRH1CCR3
SCHEMBL8938964 0.88 HRH1 (0.39) SMN1; SMN2MAOAMAOBSCN8ASCN1A
SCHEMBL8936773 0.88 HRH1 (0.46) MAOAMAOBSCN8ASCN1AHRH1
SCHEMBL8938967 0.87 HRH1 (0.44) SMN1; SMN2MAOAMAOBSCN8ASCN1A
SCHEMBL8936939 0.87 HRH1 (0.38) SMN1; SMN2MAOAMAOBSCN8ASCN1A

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 SMN1; SMN2 1282/4885MAOA 2633/4885MAOB 2595/4885

“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.