SCHEMBL6011450

SCHEMBL6011450

CCOC(=O)c1cccc(N2CCN(C(=O)O)CC2)c1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.56
MAPT P10636 7/20 0.56
MAPK1 P28482 4/20 0.56
ALOX5 P09917 1/20 0.54
LMNA P02545 7/20 0.53
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
GAA P10253 2/20 0.52
ATM Q13315 1/20 0.51
SMN1; SMN2 Q16637 3/20 0.50
TSHR P16473 3/20 0.50
HTT P42858 2/20 0.50
HPGD P15428 1/20 0.50
CASP1 P29466 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
ALOX15 P16050 1/20 0.49
USP2 O75604 1/20 0.49

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
SCHEMBL6011765 0.88 ENPP2 (0.46) ALDH1A1MAPTMAPK1LMNAMEN1
SCHEMBL8698788 0.86 PLOD2 (0.56) ALDH1A1MAPTMAPK1ALOX5LMNA
SCHEMBL20658782 0.85 NPC1 (0.55) ALDH1A1MAPTMAPK1LMNAMEN1
SCHEMBL10144997 0.85 ALOX5 (0.60) ALDH1A1MAPTMAPK1ALOX5LMNA
SCHEMBL3097713 0.85 ALOX5 (0.60) ALDH1A1MAPTMAPK1ALOX5LMNA
SCHEMBL3849915 0.85 MAPT (0.49) ALDH1A1MAPTMAPK1ALOX5LMNA
SCHEMBL6706537 0.85 TMEM97 (0.54) ALDH1A1MAPTMAPK1LMNAGAA
SCHEMBL674604 0.84 GPR119 (0.56) ALDH1A1MAPTMAPK1ALOX5LMNA
SCHEMBL2723301 0.83 MAPT (0.58) ALDH1A1MAPTMAPK1LMNAMEN1
SCHEMBL18753985 0.83 MAPT (0.56) ALDH1A1MAPTMAPK1ALOX5LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104203239-A Compounds for treating spinal muscular atrophy PTC THERAPEUTICS INC 2014-12-10 CN disclosed
US-20060270649-A1 AZETIDINE DERIVATIVES, THEIR PREPARATION AND MEDICAMENTS CONTAINING THEM AVENTIS PHARMA S.A. (FR) 2006-11-30 US disclosed
US-6858603-B2 Acetindine derivatives, their preparation and medicaments containing them AVENTIS PHARMA S.A. (FR) 2005-02-22 US disclosed
US-20040235816-A1 Azetidine derivatives, their preparation and medicaments containing them AVENTIS PHARMA S.A. (FR) 2004-11-25 US disclosed
US-20030162808-A1 Acetindine derivatives, their preparation and medicaments containing them AVENTIS PHARMA S.A. (FR) 2003-08-28 US disclosed
US-6518264-B2 For treatment/prevention of psychoses, other brain disorders, and cardiovascular disorders AVENTIS PHARMA S.A. (FR) 2003-02-11 US disclosed
US-20020035102-A1 Azetidine derivatives, their preparation and medicaments containing them AVENTIS PHARMA S.A. (FR) 2002-03-21 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 (4 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-20040235816-A1 Azetidine derivatives, their preparation and medicaments containing them AZI2, ADRA2A, ADRA2C ALDH1A1 186/4885MAPT 3259/4885MAPK1 3412/4885
US-20060270649-A1 AZETIDINE DERIVATIVES, THEIR PREPARATION AND MEDICAMENTS CONTAINING THEM AZI2, QDPR, ADRA2A ALDH1A1 303/4885MAPT 3054/4885MAPK1 3814/4885
US-20020035102-A1 Azetidine derivatives, their preparation and medicaments containing them CYP11B2, AZI2, CYP2C19 ALDH1A1 639/4885MAPT 4149/4885MAPK1 1569/4885
US-20030162808-A1 Acetindine derivatives, their preparation and medicaments containing them ADRA1D, ADRB2, AZI2 ALDH1A1 32/4885MAPT 2202/4885MAPK1 2332/4885

“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.