SCHEMBL4767695

SCHEMBL4767695

CC(C)[C@H]1COC(=O)N1C(=O)Cc1ccc(Cl)cc1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
IL6ST P40189 5/20 0.52
HPGD P15428 1/20 0.42
DRD2 P14416 1/20 0.41
DRD4 P21917 1/20 0.41
STAT3 P40763 1/20 0.41
PIK3CD O00329 1/20 0.40
IDH1 O75874 3/20 0.40
L3MBTL1 Q9Y468 2/20 0.39
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
ALDH1A1 P00352 1/20 0.38
POLB P06746 1/20 0.38
GFER P55789 1/20 0.38
ATM Q13315 1/20 0.38
TSHR P16473 1/20 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
SCHEMBL4770816 1.00 IL6ST (0.52) IL6STHPGDDRD2DRD4STAT3
SCHEMBL18174202 0.88 IL6ST (0.45) IL6STDRD2DRD4STAT3PIK3CD
SCHEMBL18174212 0.88 IL6ST (0.45) IL6STDRD2DRD4STAT3PIK3CD
SCHEMBL18174204 0.88 IL6ST (0.45) IL6STDRD2DRD4STAT3PIK3CD
SCHEMBL19183081 0.87 IL6ST (0.52) IL6STSTAT3PIK3CDIDH1ALDH1A1
SCHEMBL8225610 0.87 IL6ST (0.52) IL6STHPGDSTAT3PIK3CDIDH1
SCHEMBL4775861 0.87 IL6ST (0.52) IL6STSTAT3PIK3CDIDH1ALDH1A1
SCHEMBL4767686 0.87 IL6ST (0.52) IL6STSTAT3PIK3CDIDH1ALDH1A1
SCHEMBL9970272 0.87 IL6ST (0.66) IL6STHPGDSTAT3PIK3CDIDH1
SCHEMBL14523671 0.87 IL6ST (0.66) IL6STHPGDSTAT3PIK3CDIDH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1590326-A4 SUBSTITUTED ALKYL AMIDO PIPERIDINES LUNDBECK & CO AS H (DK) 2008-04-30 EP disclosed
US-7199135-B2 Substituted alkyl amido piperidines H. LUNDBECK A/S (DK) 2007-04-03 US disclosed
US-20060217418-A1 Substituted alkyl amido piperidines H. LUNDBECK A/S (DK) 2006-09-28 US disclosed
US-20060084649-A9 Substituted alkyl amido piperidines SYNAPTIC PHARMACEUTICAL CORPORATION (US) 2006-04-20 US disclosed
EP-1590326-A2 SUBSTITUTED ALKYL AMIDO PIPERIDINES H. Lundbeck A/S (DK) 2005-11-02 EP disclosed
US-20040186103-A1 Substituted alkyl amido piperidines SYNAPTIC PHARMACEUTICAL CORPORATION 2004-09-23 US disclosed
WO-2004064764-A2 SUBSTITUTED ALKYL AMIDO PIPERIDINES H. LUNDBECK A/S (DK) 2004-08-05 WO disclosed
EP-0776884-B1 SUBSTITUTED AMIDE DERIVATIVE BANYU PHARMA CO LTD (JP) 2000-01-05 EP disclosed
US-5643958-A ANTITUMOR BANYU PHARMACEUTICAL CO., LTD. (JP) 1997-07-01 US disclosed
EP-0776884-A1 SUBSTITUTED AMIDE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 1997-06-04 EP 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 (3 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-20060084649-A9 Substituted alkyl amido piperidines MCHR1, MCHR2, MC1R IL6ST 1991/4885HPGD 2533/4885DRD2 74/4885
US-20060217418-A1 Substituted alkyl amido piperidines MCHR1, MCHR2, MC1R IL6ST 1991/4885HPGD 2533/4885DRD2 74/4885
US-20040186103-A1 Substituted alkyl amido piperidines MCHR1, MCHR2, MC1R IL6ST 1991/4885HPGD 2533/4885DRD2 74/4885

“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.