SCHEMBL7530470

SCHEMBL7530470

COC(Cc1ccc(CCCN2c3ccccc3CC(=O)c3ccccc32)cc1)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PPARG P37231 14/20 0.49
HDAC1 Q13547 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
ALDH1A1 P00352 2/20 0.44
ALDH2 P05091 1/20 0.44
PKM P14618 1/20 0.44
ALDH3A1 P30838 1/20 0.44
PPARA Q07869 11/20 0.43
PPARD Q03181 4/20 0.42
XIAP P98170 1/20 0.41
SRR Q9GZT4 2/20 0.40
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
CYP3A4 P08684 1/20 0.39
MAPT P10636 1/20 0.39
PABPC1 P11940 1/20 0.39
BLM P54132 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL7535724 0.90 PPARG (0.62) PPARGHDAC1HDAC6ALDH1A1ALDH2
SCHEMBL7529020 0.90 PPARG (0.64) PPARGHDAC1HDAC6PPARAPPARD
SCHEMBL7528891 0.89 PPARG (0.51) PPARGHDAC1HDAC6ALDH1A1ALDH2
SCHEMBL7534527 0.89 PPARG (0.55) PPARGHDAC1HDAC6ALDH1A1ALDH2
SCHEMBL7533809 0.87 PPARG (0.63) PPARGHDAC1HDAC6PPARAPPARD
SCHEMBL7527592 0.85 PPARG (0.58) PPARGPPARAPPARDXIAPSRR
SCHEMBL7536092 0.81 PPARG (0.55) PPARGALDH1A1PPARAPPARDKMT2A
SCHEMBL7533463 0.81 PPARG (0.78) PPARGPPARAPPARD
SCHEMBL7530906 0.80 PPARG (0.68) PPARGHDAC1HDAC6PPARAPPARD
SCHEMBL7527548 0.79 PPARG (0.65) PPARGHDAC1HDAC6PPARAPPARD

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
US-20020111344-A1 Substituted hetero-polycyclic compounds as PPARalpha and PPARgamma activators JEPPESEN LONE (DK) 2002-08-15 US claimed
US-20020103188-A1 Substituted hetero-polycyclic compounds as PPARalpha and PPARgamma activators JEPPESEN LONE (DK) 2002-08-01 US claimed
US-6468996-B1 PEROXISOME PROLIFERATOR-ACTIVATED RECEPTOR ACTIVATORS; TREATMENT OF DIABETES AND OBESITY. NOVO NORDISK A/S (DK) 2002-10-22 US disclosed
US-20020115657-A1 Substituted hetero-polycyclic compounds as PPARalpha and PPARgamma JEPPESEN LONE (DK) 2002-08-22 US disclosed
US-20020111344-A1 Substituted hetero-polycyclic compounds as PPARalpha and PPARgamma activators JEPPESEN LONE (DK) 2002-08-15 US disclosed
US-20020103188-A1 Substituted hetero-polycyclic compounds as PPARalpha and PPARgamma activators JEPPESEN LONE (DK) 2002-08-01 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 (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-20020103188-A1 Substituted hetero-polycyclic compounds as PPARalpha and PPARgamma activators PPARG, PPARA, PPARD PPARG 1/4885HDAC1 120/4885HDAC6 1292/4885
US-20020115657-A1 Substituted hetero-polycyclic compounds as PPARalpha and PPARgamma PPARG, PPARA, PPARD PPARG 1/4885HDAC1 139/4885HDAC6 1163/4885
US-20020111344-A1 Substituted hetero-polycyclic compounds as PPARalpha and PPARgamma activators PPARG, PPARA, PPARD PPARG 1/4885HDAC1 72/4885HDAC6 1047/4885

“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.