SCHEMBL8937220

SCHEMBL8937220

CCc1c[nH]c(=O)c2ccc(OC3CCN(Cc4ccc(C)cc4)CC3)c(F)c12

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 2/20 0.39
CCR3 P51677 2/20 0.39
BCHE P06276 3/20 0.39
ACHE P22303 3/20 0.39
MAOA P21397 3/20 0.38
MAOB P27338 3/20 0.38
SCN8A Q9UQD0 2/20 0.38
SCN1A P35498 1/20 0.38
OPRM1 P35372 1/20 0.38
ADRB2 P07550 2/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.36
HTR1D P28221 1/20 0.36

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 0.90 HRH1 (0.42) HRH1CCR3BCHEACHEMAOA
SCHEMBL8937216 0.90 HRH1 (0.42) HRH1CCR3MAOAMAOBSCN8A
SCHEMBL8939062 0.89 HRH1 (0.41) HRH1CCR3MAOAMAOBSCN8A
SCHEMBL13890296 0.89 ACHE (0.42) HRH1CCR3BCHEACHEMAOA
SCHEMBL8937187 0.87 HRH1 (0.39) HRH1CCR3
SCHEMBL8937204 0.87 MAOA (0.49) HRH1CCR3BCHEACHEMAOA
SCHEMBL8937227 0.87 ACHE (0.43) CCR3ACHESCN8ASCN1AOPRM1
SCHEMBL8984820 0.86 KMT2A (0.43) HRH1CCR3BCHEACHESCN8A
SCHEMBL8937197 0.85 DRD2 (0.42) HRH1CCR3MAOAMAOB
SCHEMBL8937219 0.85 OPRM1 (0.41) HRH1CCR3BCHEACHESCN8A

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 3890/4885BCHE 3883/4885

“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.