SCHEMBL8915810

SCHEMBL8915810

C=CCOCCOc1ccc(C(=O)O)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.67
L3MBTL1 Q9Y468 1/20 0.67
PKM P14618 1/20 0.62
HTT P42858 3/20 0.58
RARB P10826 4/20 0.56
MAPK1 P28482 2/20 0.51
TSHR P16473 2/20 0.51
TP53 P04637 1/20 0.51
PLA2G4B P0C869 2/20 0.50
USP2 O75604 1/20 0.49
ALOX15 P16050 1/20 0.49
HSD17B10 Q99714 1/20 0.49
MAPT P10636 1/20 0.48
POLB P06746 1/20 0.48
APEX1 P27695 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
RXRA P19793 1/20 0.46
RXRB P28702 1/20 0.46
NR4A1 P22736 1/20 0.46
NR4A2 P43354 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
SCHEMBL8917659 0.98 ALDH1A1 (0.65) ALDH1A1L3MBTL1PKMHTTRARB
SCHEMBL8915809 0.98 ALDH1A1 (0.65) ALDH1A1L3MBTL1PKMHTTRARB
Hydrochloric Acid SCHEMBL11131192 0.98 ALDH1A1 (0.65) ALDH1A1L3MBTL1PKMHTTRARB
SCHEMBL8940469 0.95 RARB (0.63) ALDH1A1L3MBTL1PKMHTTRARB
SCHEMBL8940499 0.94 RARB (0.66) ALDH1A1L3MBTL1PKMHTTRARB
SCHEMBL8940419 0.94 RARB (0.66) ALDH1A1L3MBTL1PKMHTTRARB
SCHEMBL4319931 0.92 ALDH1A1 (0.69) ALDH1A1L3MBTL1PKMHTTRARB
SCHEMBL9503732 0.91 ALDH1A1 (0.68) ALDH1A1L3MBTL1PKMHTTRARB
SCHEMBL9506026 0.91 ALDH1A1 (0.68) ALDH1A1L3MBTL1PKMHTTRARB
SCHEMBL9448792 0.91 ALDH1A1 (0.68) ALDH1A1L3MBTL1PKMHTTRARB

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-5656197-A Ferroelectric liquid crystal NATIONAL SCIENCE COUNCIL (TW) 1997-08-12 US disclosed