SCHEMBL3814907

SCHEMBL3814907

O=C(O)c1cc(O)ccc1-c1ccc(Cl)cc1

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 3/20 0.79
CA1 P00915 3/20 0.52
CA2 P00918 3/20 0.52
SMN1; SMN2 Q16637 2/20 0.51
CA12 O43570 3/20 0.50
CA9 Q16790 3/20 0.50
CA7 P43166 2/20 0.50
CA14 Q9ULX7 2/20 0.50
ALOX5 P09917 1/20 0.50
PTGS2 P35354 1/20 0.50
EIF4E P06730 2/20 0.49
ALDH1A1 P00352 2/20 0.48
TP53 P04637 1/20 0.48
TSHR P16473 2/20 0.46
MEN1 O00255 1/20 0.45
USP2 O75604 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2D6 P10635 1/20 0.45
MAPT P10636 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
SCHEMBL6498907 0.89 ALDH1A1 (0.61) HSD17B10CA1CA2SMN1; SMN2ALOX5
SCHEMBL7550083 0.89 HSD17B10 (1.00) HSD17B10CA1CA2SMN1; SMN2CA12
SCHEMBL29737473 0.89 HSD17B10 (1.00) HSD17B10CA1CA2SMN1; SMN2CA12
SCHEMBL699045 0.83 HSD17B10 (0.81) HSD17B10CA1CA2SMN1; SMN2CA12
SCHEMBL10079022 0.82 HSD17B10 (0.79) HSD17B10CA1CA2SMN1; SMN2CA12
SCHEMBL8339290 0.81 MAPK1 (0.59) HSD17B10MEN1MAPTKMT2ANPC1
SCHEMBL6499129 0.81 HSD17B10 (0.51) HSD17B10CA1CA2SMN1; SMN2EIF4E
SCHEMBL6488777 0.81 ANO1 (0.52) HSD17B10CA1CA2SMN1; SMN2EIF4E
SCHEMBL7262126 0.80 HSD17B10 (0.76) HSD17B10CA1CA2SMN1; SMN2CA12
SCHEMBL30013531 0.80 HSD17B10 (0.76) HSD17B10CA1CA2SMN1; SMN2CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1953161-B1 New tricyclic derivatives, method of preparing same and pharmaceutical compositions containing them SERVIER LAB (FR) 2009-08-26 EP disclosed
WO-2008110691-A1 NOVEL TRICYCLIC DERIVATIVES, METHOD FOR PREPARING SAME AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME LES LABORATOIRES SERVIER (FR) 2008-09-18 WO disclosed
EP-1953161-A1 New tricyclic derivatives, method of preparing same and pharmaceutical compositions containing them Les Laboratoires Servier (FR) 2008-08-06 EP disclosed