SCHEMBL4234774

SCHEMBL4234774

CC(C)(Oc1cccc2c1ccn2CCCOc1ccc(-c2nn[nH]n2)cc1)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 4/20 0.54
PPARG P37231 3/20 0.54
GRM2 Q14416 11/20 0.53
PDE3A Q14432 3/20 0.52
PPARD Q03181 1/20 0.49
MCL1 Q07820 1/20 0.46
CYP19A1 P11511 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45

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
SCHEMBL4235983 0.85 PPARG (0.55) PPARAPPARGPPARDMCL1
SCHEMBL4234747 0.85 GRM2 (0.62) GRM2PDE3ACYP19A1CYP2C9CYP2C19
SCHEMBL4237971 0.82 PPARG (0.54) PPARAPPARGPPARDMCL1
SCHEMBL4236659 0.82 PPARA (0.54) PPARAPPARGPPARDMCL1
SCHEMBL4233461 0.82 PPARA (0.57) PPARAPPARGPPARDMCL1
SCHEMBL4239732 0.80 PPARA (0.56) PPARAPPARGPPARDMCL1
SCHEMBL4237886 0.76 PPARA (0.56) PPARAPPARGPPARDMCL1
SCHEMBL4241243 0.76 PPARA (0.55) PPARAPPARGPPARDMCL1
SCHEMBL4239540 0.76 PPARG (0.74) PPARAPPARGPPARD
SCHEMBL4233398 0.76 PPARA (0.58) PPARAPPARGPPARDMCL1

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
EP-1689389-A4 INDOLE COMPOUNDS NAT HEALTH RESEARCH INSTITUTES (TW) 2009-06-17 EP disclosed
US-7449478-B2 Indole compounds NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2008-11-11 US disclosed
US-7449478-B2 Indole compounds NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2008-11-11 US disclosed
US-7449478-B2 Indole compounds NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2008-11-11 US disclosed
EP-1689389-A2 INDOLE COMPOUNDS National Health Research Institutes (TW) 2006-08-16 EP disclosed
WO-2005056522-A2 INDOLE COMPOUNDS NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2005-06-23 WO disclosed
US-20050124675-A1 Indole compounds NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2005-06-09 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-20050124675-A1 Indole compounds PPARG, PPARD, PPARA PPARA 3/4885PPARG 1/4885GRM2 315/4885

“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.