SCHEMBL16078938

SCHEMBL16078938

COCC(O)COCC1CCC(COCC2CO2)CC1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
ALDH1A1 P00352 5/20 0.40
TDP1 Q9NUW8 1/20 0.40
MAPK1 P28482 1/20 0.36
PRMT5 O14744 2/20 0.34
WDR77 Q9BQA1 2/20 0.34
CYP2D6 P10635 2/20 0.32
ADRB1 P08588 2/20 0.32
LMNA P02545 2/20 0.32
MEN1 O00255 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C9 P11712 1/20 0.32
KMT2A Q03164 1/20 0.32
ADRB2 P07550 1/20 0.31
GAA P10253 1/20 0.31
BLM P54132 1/20 0.31
TMEM97 Q5BJF2 1/20 0.31
SIGMAR1 Q99720 1/20 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
SCHEMBL15831674 0.92 TSHR (0.45) TSHRSMN1; SMN2ALDH1A1TDP1MAPK1
SCHEMBL12148928 0.92 TSHR (0.45) TSHRSMN1; SMN2ALDH1A1TDP1MAPK1
SCHEMBL13399052 0.90 TSHR (0.47) TSHRSMN1; SMN2ALDH1A1TDP1MAPK1
SCHEMBL12391544 0.90 TSHR (0.47) TSHRSMN1; SMN2ALDH1A1TDP1MAPK1
SCHEMBL16075623 0.88 ALDH1A1 (0.37) TSHRSMN1; SMN2ALDH1A1TDP1MAPK1
SCHEMBL15831678 0.88 SMN1; SMN2 (0.42) TSHRSMN1; SMN2ALDH1A1TDP1MAPK1
SCHEMBL18118956 0.87 TSHR (0.41) TSHRSMN1; SMN2ALDH1A1TDP1MAPK1
SCHEMBL12148925 0.86 TSHR (0.40) TSHRSMN1; SMN2ALDH1A1TDP1MAPK1
SCHEMBL12359778 0.86 ALDH1A1 (0.46) TSHRSMN1; SMN2ALDH1A1TDP1MAPK1
SCHEMBL17383644 0.84 TSHR (0.60) TSHRSMN1; SMN2ALDH1A1TDP1MAPK1

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-20140275342-A1 EPOXY RESIN COMPOSITIONS, METHODS OF MAKING SAME, AND ARTICLES THEREOF DOW GLOBAL TECHNOLOGIES LLC (US) 2014-09-18 US disclosed