SCHEMBL17399693

SCHEMBL17399693

CCCCCCCCCCCCSCC(=O)c1ccc(O)cc1

nearest known ligand 0.63

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HSD17B3 P37058 8/20 0.63
ESR1 P03372 5/20 0.56
ESR2 Q92731 5/20 0.56
CES2 O00748 3/20 0.51
GMNN O75496 1/20 0.51
TP53 P04637 1/20 0.51
POLB P06746 1/20 0.51
MAPT P10636 1/20 0.51
THRB P10828 1/20 0.51
CYP2C9 P11712 1/20 0.51
BLM P54132 1/20 0.51
HSD17B10 Q99714 1/20 0.51
FAAH O00519 4/20 0.46
CES1 P23141 4/20 0.46
PLA2G6 O60733 1/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46

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
SCHEMBL15935741 0.93 HSD17B3 (0.61) HSD17B3ESR1ESR2POLBMAPT
SCHEMBL18737683 0.85 HDAC3 (0.50) HSD17B3CES2GMNNTP53POLB
SCHEMBL6465332 0.85 MAPT (0.58) CES2GMNNTP53POLBMAPT
SCHEMBL28437029 0.85 MAPT (0.58) CES2GMNNTP53POLBMAPT
SCHEMBL15457916 0.85 MAPT (0.58) CES2GMNNTP53POLBMAPT
SCHEMBL14998165 0.85 MAPT (0.58) CES2GMNNTP53POLBMAPT
SCHEMBL2522380 0.83 ALDH1A1 (0.58) CES2GMNNTP53POLBMAPT
SCHEMBL18737489 0.81 SMN1; SMN2 (0.57) CES2GMNNTP53POLBMAPT
SCHEMBL18737685 0.79 THRB (0.45) HSD17B3ESR1CES2GMNNTP53
SCHEMBL14534944 0.79 HDAC3 (0.53) POLBMAPTCES1NPC1RAB9A

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-1536285-B1 Photosensitive composition, compound for use in the photosensitive composition, and pattern forming method using the photosensitive composition FUJIFILM CORP (JP) 2016-01-06 EP disclosed