SCHEMBL333205

SCHEMBL333205

CCOC(=O)C=C(CC(=O)OCC)Nc1ccc(C(C)C)cc1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.50
RAB9A P51151 4/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
HPGD P15428 2/20 0.48
L3MBTL1 Q9Y468 2/20 0.48
NPC1 O15118 2/20 0.48
EPHX1 P07099 2/20 0.46
TSHR P16473 2/20 0.44
MEN1 O00255 4/20 0.43
KMT2A Q03164 4/20 0.43
MAPK1 P28482 1/20 0.43
MAPT P10636 2/20 0.42
EGFR P00533 1/20 0.42
CRHBP P24387 1/20 0.42
CRHR2 Q13324 1/20 0.42
HTT P42858 2/20 0.42
KIF11 P52732 1/20 0.41

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
SCHEMBL333204 1.00 LMNA (0.50) LMNARAB9ASMN1; SMN2HPGDL3MBTL1
SCHEMBL334894 0.86 ALDH1A1 (0.52) LMNARAB9ASMN1; SMN2HPGDL3MBTL1
SCHEMBL334895 0.86 ALDH1A1 (0.52) LMNARAB9ASMN1; SMN2HPGDL3MBTL1
SCHEMBL334167 0.85 GLA (0.49) LMNARAB9ASMN1; SMN2HPGDNPC1
SCHEMBL334168 0.85 GLA (0.49) LMNARAB9ASMN1; SMN2HPGDNPC1
SCHEMBL333639 0.84 TSHR (0.46) LMNARAB9ASMN1; SMN2L3MBTL1TSHR
SCHEMBL333640 0.84 TSHR (0.46) LMNARAB9ASMN1; SMN2L3MBTL1TSHR
SCHEMBL334254 0.83 ALDH1A1 (0.49) LMNARAB9ASMN1; SMN2HPGDL3MBTL1
SCHEMBL334253 0.83 ALDH1A1 (0.49) LMNARAB9ASMN1; SMN2HPGDL3MBTL1
SCHEMBL333618 0.83 MAPT (0.53) LMNASMN1; SMN2TSHRMEN1KMT2A

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-8097623-B2 1-Aryl-or heteroaryl-3-aryl-or heteroarylindole-2-carboxylic acids or esters: e.g., 5-(4-tert-Butylphenyl)-1,3-bis(4-isopropoxyphenyl)-indole-2-carboxylic acid; inhibition of the activity of microsomal prostaglandin E synthase-1, leukotriene C4 and/or 5-lipoxygenase-activating protein; analgesics BIOLIPOX AB (SE) 2012-01-17 US disclosed
EP-1841735-B1 INDOLES USEFUL IN THE TREATMENT OF INFLAMMATION BIOLIPOX AB (SE) 2011-03-09 EP disclosed
US-20090076004-A1 Indoles Useful in the Treatment of Inflammation BIOLIPOX AB (SE) 2009-03-19 US disclosed
CN-101142185-A Indoles useful in the treatment of inflammation BIOLIPOX AB (SE) 2008-03-12 CN disclosed
EP-1841735-A1 INDOLES USEFUL IN THE TREATMENT OF INFLAMMATION Biolipox AB (SE) 2007-10-10 EP disclosed
WO-2006077366-A1 INDOLES USEFUL IN THE TREATMENT OF INFLAMMATION BIOLIPOX AB (SE) 2006-07-27 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-20090076004-A1 Indoles Useful in the Treatment of Inflammation IDO1, IDO2, AREG LMNA 3579/4885RAB9A 2586/4885SMN1; SMN2 3963/4885

“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.