SCHEMBL6270830

SCHEMBL6270830

O=C(O)c1ccc(OCC2CC(=O)N(c3ccc(Br)cc3)C2)cc1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.47
RXRA P19793 1/20 0.47
RXRB P28702 1/20 0.47
ALDH1A1 P00352 2/20 0.44
GAA P10253 1/20 0.44
RXFP1 Q9HBX9 1/20 0.44
TP53 P04637 3/20 0.43
TSHR P16473 2/20 0.43
USP2 O75604 1/20 0.43
LMNA P02545 1/20 0.43
RECQL P46063 1/20 0.43
GLA P06280 1/20 0.43
KMT2A Q03164 3/20 0.42
MEN1 O00255 2/20 0.42
PTGER4 P35408 1/20 0.41
PTGER2 P43116 1/20 0.41
POLB P06746 2/20 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
SCHEMBL6272688 0.94 ALDH1A1 (0.48) ALDH1A1GAATP53TSHRUSP2
SCHEMBL6271800 0.89 GLA (0.46) ALDH1A1GAATP53TSHRUSP2
SCHEMBL6266719 0.89 ALDH1A1 (0.45) ALDH1A1GAATP53TSHRUSP2
SCHEMBL6265407 0.89 TP53 (0.48) MAPTALDH1A1GAATP53TSHR
SCHEMBL6269203 0.88 ALDH1A1 (0.58) MAPTALDH1A1GAATP53TSHR
SCHEMBL1060992 0.88 NPC1 (0.53) MAPTALDH1A1GAATP53TSHR
SCHEMBL6272305 0.88 KMT2A (0.53) MAPTALDH1A1GAATP53TSHR
SCHEMBL9031178 0.88 ALDH1A1 (0.53) MAPTALDH1A1GAATP53TSHR
SCHEMBL6267362 0.88 LMNA (0.55) ALDH1A1GAATP53TSHRUSP2
SCHEMBL6267398 0.88 ALDH1A1 (0.49) MAPTALDH1A1GAATP53TSHR

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
EP-1000620-B1 Lp(a)-LOWERING AGENTS AND APOPROTEIN (a) PRODUCTION INHIBITORS TAIHO PHARMACEUTICAL CO LTD (JP) 2005-12-07 EP disclosed
EP-1000620-A1 Lp(a)-LOWERING AGENTS AND APOPROTEIN (a) PRODUCTION INHIBTORS TAIHO PHARMACEUTICAL COMPANY, LIMITED (JP) 2000-05-17 EP disclosed
EP-0393607-B1 Phenylcarboxylic acid derivatives having a hetero ring OTSUKA PHARMA CO LTD (JP) 1996-02-21 EP disclosed
US-5145865-A Fatty acid, cholesterol synthesis inhibitors; enzyme inhibitors; antilipemic agents OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) 1992-09-08 US disclosed
EP-0393607-A2 Phenylcarboxylic acid derivatives having a hetero ring OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1990-10-24 EP disclosed