SCHEMBL10698412

SCHEMBL10698412

CC(C)(OOC=CC(=O)COOC(=O)O)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.41
ALDH1A1 P00352 3/20 0.38
TSHR P16473 2/20 0.38
HSD17B10 Q99714 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
ALOX15 P16050 1/20 0.36
CYP2C19 P33261 1/20 0.33
HIF1A Q16665 1/20 0.33
CES1 P23141 1/20 0.31
MAPT P10636 1/20 0.31
KMT2A Q03164 1/20 0.31
KCNN4 O15554 1/20 0.30
LMNA P02545 1/20 0.30
POLB P06746 1/20 0.30
AKT1 P31749 1/20 0.30
HTT P42858 1/20 0.30

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
SCHEMBL2772376 0.76 MAPK1 (0.43) MAPK1ALDH1A1TSHRHSD17B10TDP1
SCHEMBL9242885 0.73 MAPK1 (0.43) MAPK1ALDH1A1TSHRALOX15CYP2C19
SCHEMBL7692278 0.73 MAPK1 (0.43) MAPK1ALDH1A1TSHRHSD17B10TDP1
SCHEMBL7685063 0.72 MAPK1 (0.46) MAPK1ALDH1A1TSHRHSD17B10TDP1
SCHEMBL10435073 0.72 MAPK1 (0.42) MAPK1ALDH1A1ALOX15CYP2C19HIF1A
SCHEMBL9862043 0.72 MAPK1 (0.39) MAPK1ALDH1A1TDP1ALOX15MAPT
SCHEMBL8526043 0.70 MAPK1 (0.43) MAPK1ALDH1A1TSHRHSD17B10TDP1
SCHEMBL10477188 0.70 MAPK1 (0.40) MAPK1ALDH1A1TSHRALOX15CES1
SCHEMBL9862015 0.70 HCAR2 (0.35) MAPK1ALDH1A1MAPTKMT2ALMNA
SCHEMBL8740112 0.69 MAPK1 (0.57) MAPK1ALDH1A1TSHRHSD17B10TDP1

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
EP-0277608-A2 Graft polymerization preformer and method of manufacturing the same NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1988-08-10 EP disclosed