SCHEMBL11286166

SCHEMBL11286166

O=C(CCc1[c]cccc1)OCc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.51
MAPK1 P28482 2/20 0.51
L3MBTL1 Q9Y468 2/20 0.51
TDP1 Q9NUW8 2/20 0.51
LMNA P02545 2/20 0.44
KMT2A Q03164 2/20 0.44
SLC6A2 P23975 1/20 0.44
SLC6A3 Q01959 1/20 0.44
CASP1 P29466 1/20 0.41
NOTUM Q6P988 1/20 0.41
FFAR1 O14842 1/20 0.41
FFAR4 Q5NUL3 1/20 0.41
MAPT P10636 2/20 0.41
MEN1 O00255 1/20 0.41
POLB P06746 1/20 0.41
HCAR2 Q8TDS4 1/20 0.41
CDC25B P30305 1/20 0.40

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
SCHEMBL11279075 0.84 ALDH1A1 (0.64) ALDH1A1MAPK1L3MBTL1TDP1LMNA
SCHEMBL11285611 0.81 CYP4F2 (0.54) ALDH1A1TDP1LMNAMAPT
SCHEMBL304176 0.80 TDP1 (0.78) ALDH1A1MAPK1L3MBTL1TDP1LMNA
SCHEMBL11285006 0.80 KMT2A (0.48) ALDH1A1L3MBTL1TDP1LMNAKMT2A
SCHEMBL28207503 0.79 TDP1 (0.75) ALDH1A1MAPK1L3MBTL1TDP1LMNA
Ammonia Solution, Strong SCHEMBL28588274 0.79 TDP1 (0.75) ALDH1A1MAPK1L3MBTL1TDP1LMNA
Bicarbonate SCHEMBL7699565 0.79 TDP1 (0.75) ALDH1A1MAPK1L3MBTL1TDP1LMNA
SCHEMBL29073047 0.78 LMNA (0.58) L3MBTL1LMNAKMT2AMAPTMEN1
SCHEMBL11286167 0.78 TDP1 (0.64) ALDH1A1MAPK1L3MBTL1TDP1LMNA
SCHEMBL1177836 0.78 ALDH1A1 (0.73) ALDH1A1MAPK1L3MBTL1TDP1LMNA

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-4348410-A Cyclohexane carboxylic acid derivatives NIPPON CHEMIPHAR CO., LTD. (JP) 1982-09-07 US disclosed