SCHEMBL11293302

SCHEMBL11293302

COCc1ccc(C(=O)C(O)c2ccc(COC)cc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 3/20 0.49
CES1 P23141 3/20 0.49
LMNA P02545 1/20 0.47
ALDH1A1 P00352 5/20 0.45
KDM4E B2RXH2 2/20 0.45
TSHR P16473 1/20 0.44
HSD17B10 Q99714 1/20 0.44
RXRA P19793 2/20 0.42
RXRB P28702 1/20 0.42
MAPT P10636 2/20 0.39
HTT P42858 1/20 0.39
ACACB O00763 1/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
POLB P06746 1/20 0.38
ESR1 P03372 1/20 0.38
ESR2 Q92731 1/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37

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
Benzoin SCHEMBL4391195 0.85 LMNA (0.66) CES2CES1LMNAALDH1A1KDM4E
SCHEMBL2297437 0.80 ALDH1A1 (0.53) CES2CES1LMNAALDH1A1KDM4E
SCHEMBL12489656 0.78 ALDH1A1 (0.48) CES2CES1LMNAALDH1A1MAPT
SCHEMBL15520812 0.77 ACACB (0.42) LMNAALDH1A1KDM4ETSHRHSD17B10
SCHEMBL6836761 0.77 CES2 (0.46) CES2CES1LMNAALDH1A1KDM4E
SCHEMBL28291616 0.77 CES2 (0.53) CES2CES1LMNAALDH1A1KDM4E
SCHEMBL68736 0.77 CES2 (0.55) CES2CES1LMNAALDH1A1KDM4E
SCHEMBL10777249 0.77 CA1 (0.53) CES2CES1LMNAALDH1A1KDM4E
Hydrochloric Acid SCHEMBL22614742 0.76 ACACB (0.41) LMNAALDH1A1KDM4ERXRARXRB
SCHEMBL6208081 0.75 RAB9A (0.59) ALDH1A1RXRARXRBMAPTHTT

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-0061150-A1 Light-sensitive polycondensation product, process for its preparation and light-sensitive recording material containing the same AMERICAN HOECHST CORPORATION (US) 1982-09-29 EP disclosed