SCHEMBL8937216

SCHEMBL8937216

CCc1c[nH]c(=O)c2ccc(OC3CCN(Cc4cc(Cl)cc(Cl)c4)CC3)c(F)c12

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 8/20 0.42
CCR3 P51677 8/20 0.42
MAOA P21397 3/20 0.40
MAOB P27338 3/20 0.40
SSTR5 P35346 2/20 0.38
KCNH2 Q12809 2/20 0.37
POLB P06746 1/20 0.37
SCN1A P35498 1/20 0.35
SCN8A Q9UQD0 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL8939062 0.96 HRH1 (0.41) HRH1CCR3MAOAMAOBSSTR5
SCHEMBL8937204 0.93 MAOA (0.49) HRH1CCR3MAOAMAOBSCN1A
SCHEMBL8936704 0.91 HRH1 (0.45) HRH1CCR3MAOAMAOBSSTR5
SCHEMBL8937220 0.90 HRH1 (0.39) HRH1CCR3MAOAMAOBSCN1A
SCHEMBL8938967 0.86 HRH1 (0.44) HRH1CCR3MAOAMAOBKCNH2
SCHEMBL13890296 0.86 ACHE (0.42) HRH1CCR3MAOAMAOBSCN1A
SCHEMBL8937187 0.86 HRH1 (0.39) HRH1CCR3KCNH2
SCHEMBL8937219 0.86 OPRM1 (0.41) HRH1CCR3SCN1ASCN8A
SCHEMBL8937227 0.86 ACHE (0.43) CCR3SCN1ASCN8A
SCHEMBL8937197 0.84 DRD2 (0.42) HRH1CCR3MAOAMAOBKCNH2

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 HRH1 2936/4885CCR3 3890/4885MAOA 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.