SCHEMBL2405491

SCHEMBL2405491

CCCC=CCCC(=O)OC(=O)CCC=CCCC

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.56
PPARG P37231 4/20 0.39
MAPT P10636 3/20 0.39
CYP19A1 P11511 2/20 0.39
FFAR1 O14842 1/20 0.39
RXRA P19793 1/20 0.39
OXER1 Q8TDS5 1/20 0.39
TERT O14746 3/20 0.38
PTPN1 P18031 3/20 0.38
PPARD Q03181 3/20 0.38
PPARA Q07869 3/20 0.38
TOP1 P11387 3/20 0.38
CYP1A2 P05177 2/20 0.38
CYP2C19 P33261 2/20 0.38
BLM P54132 2/20 0.38
HSD17B10 Q99714 2/20 0.38
FABP4 P15090 2/20 0.38
F7 P08709 2/20 0.38
F3 P13726 2/20 0.38
FAAH O00519 2/20 0.38

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
SCHEMBL2405490 1.00 ALDH1A1 (0.56) ALDH1A1PPARGMAPTCYP19A1FFAR1
SCHEMBL29210332 0.89 ALDH1A1 (0.44) ALDH1A1PPARGMAPTCYP19A1FFAR1
SCHEMBL28891418 0.85 TERT (0.44) ALDH1A1PPARGMAPTCYP19A1TERT
SCHEMBL9199036 0.85 PPARG (0.57) ALDH1A1PPARGMAPTCYP19A1FFAR1
SCHEMBL29391944 0.85 PPARG (0.57) ALDH1A1PPARGMAPTCYP19A1FFAR1
SCHEMBL7700884 0.84 TSHR (0.52) ALDH1A1OXER1KMT2ALMNAPOLB
SCHEMBL18339165 0.84 TSHR (0.52) ALDH1A1OXER1KMT2ALMNAPOLB
SCHEMBL3506096 0.84 TSHR (0.52) ALDH1A1OXER1KMT2ALMNAPOLB
SCHEMBL9197695 0.83 TERT (0.60) PPARGMAPTCYP19A1TERTPTPN1
SCHEMBL3505842 0.82 NR1I2 (0.55) ALDH1A1MAPTCYP1A2HSD17B10FAAH

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-2011110349-A2 PROCESS FOR THE PREPARATION OF DICARBOXYLIC ACIDS OR DICARBOXYLIC ACID ESTERS BY METATHESIS EMERY OLEOCHEMICALS GMBH (DE) 2011-09-15 WO disclosed