SCHEMBL4672476

SCHEMBL4672476

CCCC(OC=O)c1ccc(C)cc1

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36
UTS2R Q9UKP6 1/20 0.34
FFAR1 O14842 1/20 0.34
GCGR P47871 1/20 0.33
CYP2A6 P11509 1/20 0.33
SLC6A4 P31645 4/20 0.33
SLC6A3 Q01959 3/20 0.33
SLC6A2 P23975 3/20 0.33
STAT3 P40763 1/20 0.33
SRC P12931 1/20 0.32
HRH3 Q9Y5N1 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
ACHE P22303 1/20 0.32
ALOX5 P09917 1/20 0.32
CHRNA7 P36544 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
SCHEMBL4670365 0.85 ALDH1A1 (0.37) CA2CA9UTS2RFFAR1CYP2A6
SCHEMBL4669959 0.84 AOC3 (0.39) SLC6A4SLC6A3SLC6A2HRH3ALDH1A1
SCHEMBL8750494 0.79 CHRNA7 (0.41) CA12CA2CA9UTS2RFFAR1
SCHEMBL12014018 0.77 AOC3 (0.37) CA12CA2CA9UTS2RFFAR1
SCHEMBL4672469 0.75 CA12 (0.36) CA12CA2CA9UTS2RFFAR1
SCHEMBL9572581 0.74 POLB (0.42) ALDH1A1
SCHEMBL16673003 0.74 UTS2R (0.45) UTS2RFFAR1GCGRSLC6A4SLC6A3
SCHEMBL9572555 0.72 SLC7A5 (0.40) ALDH1A1LMNASMN1; SMN2
SCHEMBL16111752 0.72 CA2 (0.41) CA12CA2CA9UTS2RFFAR1
SCHEMBL28780408 0.71 ALDH1A1 (0.40) ALDH1A1SMN1; SMN2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080124552-A1 Particle With Rough Surface For Plating Or Vapor Deposition NISSHINBO INDUSTRIES, INC. (JP) 2008-05-29 US disclosed
US-5821277-A Thermosetting and procuring compositions for color filters and method for making the same NIPPON OIL CO., LTD. (JP) 1998-10-13 US disclosed