SCHEMBL20006762

SCHEMBL20006762

CCCC(CC)CCc1cc(F)ccc1O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.40
MAPT P10636 2/20 0.40
XBP1 P17861 1/20 0.40
HIF1A Q16665 1/20 0.40
HMGCR P04035 1/20 0.37
TYR P14679 2/20 0.35
ALOX5 P09917 1/20 0.35
ALDH1A1 P00352 1/20 0.35
HPGD P15428 1/20 0.35
F2RL1 P55085 3/20 0.34
ANO1 Q5XXA6 1/20 0.34
LTB4R Q15722 1/20 0.34
LTB4R2 Q9NPC1 1/20 0.34
KCNH2 Q12809 1/20 0.33
KDM4E B2RXH2 1/20 0.33
TP53 P04637 1/20 0.33
ALOX15 P16050 1/20 0.33
MAPK1 P28482 1/20 0.33
HTT P42858 1/20 0.33
HSD17B10 Q99714 1/20 0.33

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
SCHEMBL13625815 0.79 HMGCR (0.55) LMNAMAPTXBP1HIF1AHMGCR
SCHEMBL12520531 0.76 TYR (0.56) LMNAMAPTXBP1HIF1AHMGCR
SCHEMBL1270868 0.75 ALOX5 (0.56) LMNAMAPTHMGCRTYRALOX5
SCHEMBL15177138 0.73 ALOX5 (0.59) LMNAMAPTTYRALOX5ALDH1A1
SCHEMBL12063304 0.73 EPHX2 (0.44) LMNAMAPTXBP1HIF1AHPGD
SCHEMBL12063308 0.73 TYR (0.39) LMNAMAPTXBP1HIF1ATYR
SCHEMBL364672 0.72 ESR1 (0.53) LMNAMAPTALDH1A1HPGDKDM4E
SCHEMBL20628898 0.71 IDO1 (0.43) KCNH2KDM4E
SCHEMBL5326448 0.71 TYR (0.37) LMNAMAPTXBP1HIF1ATYR
SCHEMBL5326452 0.71 TYR (0.37) LMNAMAPTXBP1HIF1ATYR

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-3299364-A1 NEBIVOLOL SYNTHESIS METHOD AND INTERMEDIATE COMPOUND THEREOF Zhejiang Ausun Pharmaceutical Co., Ltd. (CN) 2018-03-28 EP disclosed