SCHEMBL6496296

SCHEMBL6496296

C/C(=C\CO)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.50
MAPT P10636 3/20 0.50
L3MBTL1 Q9Y468 2/20 0.46
WDR5 P61964 1/20 0.45
HPGD P15428 2/20 0.43
ALDH1A1 P00352 2/20 0.42
KDM4E B2RXH2 1/20 0.42
USP2 O75604 1/20 0.42
PTPN1 P18031 1/20 0.41
GSK3B P49841 1/20 0.41
PPARG P37231 1/20 0.41
PPARD Q03181 1/20 0.41
PPARA Q07869 1/20 0.41
GRIN2B Q13224 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
SCHEMBL5525240 1.00 SMN1; SMN2 (0.50) SMN1; SMN2MAPTL3MBTL1WDR5HPGD
SCHEMBL5525241 1.00 SMN1; SMN2 (0.50) SMN1; SMN2MAPTL3MBTL1WDR5HPGD
SCHEMBL6484484 0.93 MAPT (0.44) SMN1; SMN2MAPTL3MBTL1WDR5
SCHEMBL3588721 0.87 KDM1A (0.47)
SCHEMBL2171729 0.87 KDM1A (0.47)
SCHEMBL2171728 0.87 KDM1A (0.47)
SCHEMBL11488255 0.86 SMN1; SMN2 (0.48) SMN1; SMN2MAPTL3MBTL1WDR5HPGD
SCHEMBL11878664 0.85 SMN1; SMN2 (0.47) SMN1; SMN2MAPTL3MBTL1WDR5HPGD
SCHEMBL11881044 0.85 SMN1; SMN2 (0.47) SMN1; SMN2MAPTL3MBTL1WDR5HPGD
SCHEMBL6484429 0.83 HSD17B2 (0.46) MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070043035-A1 Novel compounds and their use in medicine: process for their preparation and pharmaceutical compositions containing them DR. REDDY'S LABORATORIES LIMITED (IN) 2007-02-22 US disclosed
US-20070043035-A1 Novel compounds and their use in medicine: process for their preparation and pharmaceutical compositions containing them DR. REDDY'S LABORATORIES LIMITED (IN) 2007-02-22 US disclosed
US-6867218-B2 Compounds, their preparation and use NOVO NORDISK A/S (DK) 2005-03-15 US disclosed
US-20030195200-A1 Compounds, their preparation and use VTVX HOLDINGS II LLC 2003-10-16 US disclosed
US-6555577-B1 For treatment and/or prevention of conditions mediated by the Peroxisome Proliferator-Activated Receptors (PPAR), such as diabetes and/or obesity; 3-(4-(3-Biphenyl-4-yl-but-2-enyloxy)-phenyl)-2-butoxy-propionic acid for example NOVO NORDISK A/S (DE) 2003-04-29 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 (2 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-20070043035-A1 Novel compounds and their use in medicine: process for their preparation and pharmaceutical compositions containing them GPR119, LIPA, LIPC SMN1; SMN2 4582/4885MAPT 4179/4885L3MBTL1 4808/4885
US-20030195200-A1 Compounds, their preparation and use PPARG, PPARA, PPARD SMN1; SMN2 3127/4885MAPT 3845/4885L3MBTL1 4771/4885

“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.