SCHEMBL13659207

SCHEMBL13659207

CC(=O)N1CCN(c2ccc3c(c2)CCN(c2ccc(N4CC[C@@H](N(C)C)C4)c(F)c2)C3=O)CC1

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FPR1 P21462 2/20 0.46
FPR2 P25090 2/20 0.46
MAOB P27338 2/20 0.45
MAOA P21397 1/20 0.42
CYP11B1 P15538 1/20 0.40
CYP11B2 P19099 1/20 0.40
RORC P51449 10/20 0.39
EED O75530 5/20 0.38

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
SCHEMBL13659205 0.90 FPR1 (0.46) FPR1FPR2MAOBMAOA
SCHEMBL4290289 0.89 FPR1 (0.47) FPR1FPR2MAOBMAOA
SCHEMBL4290282 0.89 FPR1 (0.47) FPR1FPR2MAOBMAOA
SCHEMBL4296913 0.89 FPR1 (0.45) FPR1FPR2MAOBMAOA
SCHEMBL4296914 0.89 FPR1 (0.45) FPR1FPR2MAOBMAOA
SCHEMBL13659199 0.87 FPR1 (0.46) FPR1FPR2MAOBMAOA
SCHEMBL4303194 0.86 FPR1 (0.43) FPR1FPR2MAOBMAOA
SCHEMBL4303190 0.86 FPR1 (0.43) FPR1FPR2MAOBMAOA
SCHEMBL13659198 0.86 FPR1 (0.48) FPR1FPR2MAOBMAOACYP11B1
SCHEMBL4287520 0.86 FPR1 (0.49) FPR1FPR2MAOBMAOACYP11B1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8822495-B2 Azacyclyl-substituted aryldihydroisoquinolinones, process for their preparation and their use as medicaments SANOFI (FR) 2014-09-02 US disclosed
US-8822495-B2 Azacyclyl-substituted aryldihydroisoquinolinones, process for their preparation and their use as medicaments SANOFI (FR) 2014-09-02 US disclosed
US-20090264403-A1 NOVEL AZACYCLYL-SUBSTITUTED ARYLDIHYDROISOQUINOLINONES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS MEDICAMENTS SANOFI-AVENTIS (FR) 2009-10-22 US disclosed
US-20090264403-A1 NOVEL AZACYCLYL-SUBSTITUTED ARYLDIHYDROISOQUINOLINONES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS MEDICAMENTS SANOFI-AVENTIS (FR) 2009-10-22 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-20090264403-A1 NOVEL AZACYCLYL-SUBSTITUTED ARYLDIHYDROISOQUINOLINONES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS MEDICAMENTS MCHR1, MRGPRX1, MRGPRX4 FPR1 626/4885FPR2 534/4885MAOB 827/4885

“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.