SCHEMBL11601752

SCHEMBL11601752

Cc1ccccc1SCCCC(=O)O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.61
PTGS2 P35354 3/20 0.55
SMN1; SMN2 Q16637 3/20 0.54
CYSLTR2 Q9NS75 1/20 0.48
CYSLTR1 Q9Y271 1/20 0.48
RAB9A P51151 2/20 0.47
MAPT P10636 1/20 0.47
NPC1 O15118 1/20 0.45
LTB4R Q15722 1/20 0.44
ITGB3 P05106 1/20 0.43
ITGAV P06756 1/20 0.43
MAP2K7 O14733 1/20 0.43
CDC25A P30304 1/20 0.43
CDC25B P30305 1/20 0.43
HDAC3 O15379 1/20 0.43
MAPK1 P28482 1/20 0.43
ADRA1A P35348 1/20 0.43
HDAC4 P56524 1/20 0.43
SLC6A3 Q01959 1/20 0.43
HDAC1 Q13547 1/20 0.43

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
SCHEMBL21102151 0.93 PTGS2 (0.63) ALDH1A1PTGS2SMN1; SMN2CYSLTR2CYSLTR1
SCHEMBL5637483 0.89 SMN1; SMN2 (0.56) ALDH1A1PTGS2SMN1; SMN2CYSLTR2CYSLTR1
SCHEMBL8157886 0.82 PTGS2 (0.66) ALDH1A1PTGS2SMN1; SMN2CYSLTR2CYSLTR1
SCHEMBL8155943 0.82 PTGS2 (0.66) ALDH1A1PTGS2SMN1; SMN2CYSLTR2CYSLTR1
SCHEMBL8162845 0.82 PTGS2 (0.66) ALDH1A1PTGS2SMN1; SMN2CYSLTR2CYSLTR1
SCHEMBL8156044 0.82 PTGS2 (0.66) ALDH1A1PTGS2SMN1; SMN2CYSLTR2CYSLTR1
SCHEMBL8164521 0.82 PTGS2 (0.66) ALDH1A1PTGS2SMN1; SMN2CYSLTR2CYSLTR1
SCHEMBL8159641 0.82 PTGS2 (0.66) ALDH1A1PTGS2SMN1; SMN2CYSLTR2CYSLTR1
SCHEMBL8156427 0.82 PTGS2 (0.66) ALDH1A1PTGS2SMN1; SMN2CYSLTR2CYSLTR1
SCHEMBL8158320 0.82 PTGS2 (0.66) ALDH1A1PTGS2SMN1; SMN2CYSLTR2CYSLTR1

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-4086240-A 1-Thiazolyl-5-phenoxy and phenylthioalkanoyloxyimidazolidinones VELSICOL CHEMICAL CORPORATION (US) 1978-04-25 US disclosed
US-4053480-A 1-THIADIAZOLYL-5-PHENOXY- AND PHENYLTHIOALKANOYLOXY IMIDAZOLIDINONES VELSICOL CHEMICAL CORPORATION (US) 1977-10-11 US disclosed