SCHEMBL4405521

SCHEMBL4405521

Cc1cc2cc(C(=O)O)ccc2n1-c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 3/20 0.61
ALDH1A1 P00352 6/20 0.51
KDM4E B2RXH2 4/20 0.51
MAPT P10636 3/20 0.51
POLB P06746 3/20 0.51
TDP1 Q9NUW8 3/20 0.51
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
L3MBTL1 Q9Y468 2/20 0.51
MYC P01106 2/20 0.51
ALOX15 P16050 2/20 0.51
PTPN7 P35236 2/20 0.51
NR4A1 P22736 2/20 0.51
GAA P10253 2/20 0.51
NOTUM Q6P988 1/20 0.51
USP2 O75604 1/20 0.51
HSPA1A P0DMV8 1/20 0.51
RECQL P46063 1/20 0.51
BLM P54132 1/20 0.51
APEX1 P27695 2/20 0.49

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
SCHEMBL5332169 0.88 HSD17B10 (0.57) HSD17B10ALDH1A1KDM4EMAPTPOLB
SCHEMBL12089746 0.87 NOTUM (0.55) HSD17B10ALDH1A1KDM4EMAPTPOLB
SCHEMBL18950564 0.81 HSD17B10 (0.54) HSD17B10ALDH1A1KDM4EMAPTPOLB
SCHEMBL29134576 0.81 HSD17B10 (0.47) HSD17B10ALDH1A1KDM4EMAPTPOLB
SCHEMBL1664109 0.81 ALDH1A1 (0.53) HSD17B10ALDH1A1KDM4EMAPTPOLB
SCHEMBL12094386 0.80 HAO1 (0.55) HSD17B10ALDH1A1KDM4EMAPTMEN1
SCHEMBL11723689 0.78 ALDH1A1 (0.44) HSD17B10ALDH1A1KDM4EMAPTTDP1
SCHEMBL3987986 0.77 KDM4E (0.55) HSD17B10ALDH1A1KDM4EMAPTTDP1
SCHEMBL30622485 0.77 KDM4E (0.55) HSD17B10ALDH1A1KDM4EMAPTTDP1
SCHEMBL28025054 0.77 MYC (0.45) HSD17B10ALDH1A1KDM4EMAPTPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009047240-A1 INDOLE DERIVATIVES USEFUL AS PPAR ACTIVATORS SMITHKLINE BEECHAM CORPORATION (US) 2009-04-16 WO disclosed