SCHEMBL2811528

SCHEMBL2811528

Cc1ccc(-c2cccc(C(=O)NCCc3cccs3)c2)cc1Cn1c(C(=O)O)c(-c2ccc(C(C)(C)C)cc2)c2ccccc21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.47
SERPINE1 P05121 2/20 0.43
POLB P06746 1/20 0.42
NPC1 O15118 3/20 0.40
RAB9A P51151 3/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CDK4 P11802 2/20 0.39
CCND1 P24385 2/20 0.39
PPARG P37231 2/20 0.38
NAMPT P43490 1/20 0.38
MEN1 O00255 1/20 0.37
USP2 O75604 1/20 0.37
ALDH1A1 P00352 1/20 0.37
KMT2A Q03164 1/20 0.37
ESRRG P62508 1/20 0.37
LMNA P02545 2/20 0.37
TP53 P04637 1/20 0.37
EDNRB P24530 2/20 0.36
EDNRA P25101 2/20 0.36
THRB P10828 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
SCHEMBL2814338 0.95 MAPT (0.49) MAPTSERPINE1POLBNPC1RAB9A
SCHEMBL2811523 0.93 MAPT (0.52) MAPTSERPINE1POLBPPARGMEN1
SCHEMBL2809968 0.88 MAPT (0.54) MAPTSERPINE1POLBRAB9APPARG
SCHEMBL2807069 0.85 SERPINE1 (0.51) MAPTSERPINE1PPARGMEN1USP2
SCHEMBL2810186 0.79 SERPINE1 (0.54) MAPTSERPINE1PPARGMEN1USP2
SCHEMBL14270631 0.78 SERPINE1 (0.44) MAPTSERPINE1NPC1RAB9ACDK4
SCHEMBL2807914 0.77 SERPINE1 (0.54) MAPTSERPINE1SMN1; SMN2PPARGMEN1
SCHEMBL2813528 0.77 SERPINE1 (0.50) MAPTSERPINE1SMN1; SMN2PPARGMEN1
SCHEMBL2808598 0.77 SERPINE1 (0.44) MAPTSERPINE1NPC1RAB9ASMN1; SMN2
SCHEMBL2809001 0.76 SERPINE1 (0.50) MAPTSERPINE1SMN1; SMN2CDK4CCND1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2081894-A1 1H-INDOLE-2-CARBOXYLIC ACID DERIVATIVES USEFUL AS PPAR MODULATORS SmithKline Beecham Corporation (US) 2009-07-29 EP claimed
WO-2008028118-A1 1H-INDOLE-2-CARBOXYLIC ACID DERIVATIVES USEFUL AS PPAR MODULATORS SMITHKLINE BEECHAM CORPORAITON (US) 2008-03-06 WO claimed
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 MAPT 2916/4885SERPINE1 4215/4885POLB 3330/4885

“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.