SCHEMBL15023930

SCHEMBL15023930

CN1C(C)(C)CCC(C(CC(C)(Cc2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)OC(=O)CC(=O)O)C2CCC(C)(C)N(C)C2(C)C)C1(C)C

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.32
HTT P42858 2/20 0.32
PKM P14618 1/20 0.32
MAOB P27338 6/20 0.31
ALDH1A1 P00352 5/20 0.31
MAPT P10636 3/20 0.31
MEN1 O00255 2/20 0.31
CYP1A2 P05177 2/20 0.31
CYP3A4 P08684 2/20 0.31
TSHR P16473 2/20 0.31
MAPK1 P28482 2/20 0.31
BLM P54132 2/20 0.31
KMT2A Q03164 2/20 0.31
ATM Q13315 2/20 0.31
HIF1A Q16665 2/20 0.31
NPSR1 Q6W5P4 2/20 0.31
MAOA P21397 2/20 0.31
USP2 O75604 1/20 0.31
CYP2D6 P10635 1/20 0.31
KDM4E B2RXH2 2/20 0.31

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
SCHEMBL697947 0.84 ALDH1A1 (0.33) GAAHTTPKMMAOBALDH1A1
SCHEMBL697945 0.79 ALDH1A1 (0.35) GAAHTTPKMALDH1A1MAPT
SCHEMBL7928015 0.78 CYP2D6 (0.34) GAAHTTPKMALDH1A1MAPT
SCHEMBL1788650 0.76 ALDH1A1 (0.33) GAAHTTPKMMAOBALDH1A1
SCHEMBL7928011 0.73 CYP2D6 (0.33) GAAHTTPKMALDH1A1MAPT
SCHEMBL29816287 0.73 GAA (0.34) GAAHTTPKMMAOBALDH1A1
SCHEMBL697944 0.73 GAA (0.34) GAAHTTPKMMAOBALDH1A1
SCHEMBL6359443 0.72 GAA (0.34) GAAHTTPKMMAOBALDH1A1
SCHEMBL6446600 0.72 KMT2A (0.46) GAAALDH1A1MAPTMEN1CYP1A2
SCHEMBL28848452 0.69 GAA (0.36) GAAHTTPKMALDH1A1MAPT

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
US-20130155497-A1 FILM MIRROR FOR SOLAR THERMAL POWER GENERATION,EMTHOD FOR PRODUCING FILM MIRROR FOR SOLAR THERMAL POWER GENERATION, AND REFLECTNG DEVICE FOR SOLAR THERMAL POWER GENERATION KONICA MINOLTA ADVANCED LAYERS, INC. (JP) 2013-06-20 US disclosed