SCHEMBL2806043

SCHEMBL2806043

CCOC(=O)c1c(-c2ccc(C(C)(C)C)cc2)c2ccccc2n1Cc1cc(O)cc(OCC2CC2)c1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SERPINE1 P05121 2/20 0.41
TP53 P04637 1/20 0.38
PPARG P37231 6/20 0.38
KDM4E B2RXH2 3/20 0.37
FOLH1 Q04609 1/20 0.37
KMT2A Q03164 1/20 0.36
MDM2 Q00987 2/20 0.36
LMNA P02545 2/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
PKM P14618 1/20 0.36
MDM4 O15151 1/20 0.36
PTGER4 P35408 3/20 0.36
SSTR5 P35346 1/20 0.36
KCNH2 Q12809 1/20 0.36

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
SCHEMBL2806464 0.93 SERPINE1 (0.41) SERPINE1PPARGKDM4EFOLH1KMT2A
SCHEMBL2806679 0.90 SERPINE1 (0.51) SERPINE1PPARGFOLH1
SCHEMBL2808120 0.90 SERPINE1 (0.43) SERPINE1PPARGFOLH1KMT2AMDM2
SCHEMBL2811167 0.87 PTGER4 (0.42) SERPINE1TP53PPARGKDM4EFOLH1
SCHEMBL2807163 0.86 SERPINE1 (0.53) SERPINE1PPARGFOLH1
SCHEMBL2809844 0.85 PPARG (0.43) SERPINE1TP53PPARGKDM4EFOLH1
SCHEMBL2806740 0.84 SERPINE1 (0.49) SERPINE1PPARGFOLH1
SCHEMBL2807519 0.83 SERPINE1 (0.50) SERPINE1PPARGFOLH1
SCHEMBL2807202 0.83 PTGER4 (0.44) SERPINE1TP53PPARGFOLH1KMT2A
SCHEMBL2806705 0.82 SERPINE1 (0.50) SERPINE1PPARGFOLH1PTGER4SSTR5

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-20100240642-A1 1H-Indole-2-Carboxylic Acid Derivatives Useful As PPAR Modulators SMITHKLINE BEECHAM CORPORATION (US) 2010-09-23 US disclosed
US-20100240642-A1 1H-Indole-2-Carboxylic Acid Derivatives Useful As PPAR Modulators SMITHKLINE BEECHAM CORPORATION (US) 2010-09-23 US disclosed
US-20100240642-A1 1H-Indole-2-Carboxylic Acid Derivatives Useful As PPAR Modulators SMITHKLINE BEECHAM CORPORATION (US) 2010-09-23 US disclosed
EP-2081894-A1 1H-INDOLE-2-CARBOXYLIC ACID DERIVATIVES USEFUL AS PPAR MODULATORS SmithKline Beecham Corporation (US) 2009-07-29 EP disclosed
WO-2008028118-A1 1H-INDOLE-2-CARBOXYLIC ACID DERIVATIVES USEFUL AS PPAR MODULATORS SMITHKLINE BEECHAM CORPORAITON (US) 2008-03-06 WO disclosed
WO-2008028118-A1 1H-INDOLE-2-CARBOXYLIC ACID DERIVATIVES USEFUL AS PPAR MODULATORS SMITHKLINE BEECHAM CORPORAITON (US) 2008-03-06 WO 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-20100240642-A1 1H-Indole-2-Carboxylic Acid Derivatives Useful As PPAR Modulators PPARD, PPARA, PPARG SERPINE1 4215/4885TP53 1320/4885PPARG 3/4885

“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.