SCHEMBL13891748

SCHEMBL13891748

C=C(C)C(=O)Oc1ccc(COc2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.51
ALOX5 P09917 3/20 0.50
PTGS1 P23219 1/20 0.50
PTGS2 P35354 1/20 0.50
L3MBTL1 Q9Y468 2/20 0.49
MAOB P27338 1/20 0.49
NOX1 Q9Y5S8 2/20 0.48
ALDH1A1 P00352 2/20 0.48
HTT P42858 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
TSPO P30536 1/20 0.46
EGFR P00533 2/20 0.46
GAA P10253 1/20 0.46
MAPT P10636 1/20 0.46
RAB9A P51151 1/20 0.46
FFAR1 O14842 1/20 0.45
FFAR4 Q5NUL3 1/20 0.45
RXRA P19793 1/20 0.45
RXRB P28702 1/20 0.45
LTB4R Q15722 1/20 0.44

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
SCHEMBL172208 0.90 ELANE (0.51) ELANEALOX5PTGS1PTGS2L3MBTL1
SCHEMBL8925614 0.88 ELANE (0.55) ELANEPTGS2ALDH1A1SMN1; SMN2GAA
SCHEMBL28062290 0.88 MAOB (0.62) ELANEALOX5PTGS1PTGS2L3MBTL1
SCHEMBL9915684 0.88 ELANE (0.64) ELANEL3MBTL1ALDH1A1SMN1; SMN2GAA
SCHEMBL172511 0.88 ELANE (0.64) ELANEL3MBTL1ALDH1A1SMN1; SMN2GAA
SCHEMBL9915770 0.88 FFAR1 (0.49) ELANEL3MBTL1HTTFFAR1
SCHEMBL11938787 0.87 ELANE (0.54) ELANEL3MBTL1ALDH1A1SMN1; SMN2RAB9A
SCHEMBL17433308 0.86 MAOB (0.53) ELANEALOX5PTGS1PTGS2L3MBTL1
SCHEMBL11987078 0.84 ELANE (0.46) ELANEALOX5PTGS1PTGS2L3MBTL1
SCHEMBL170754 0.84 ELANE (0.48) ELANEALDH1A1SMN1; SMN2MAPTRAB9A

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-7517625-B2 Electrophotographic photoreceptor with improved durability and wear resistance; high quality latent images; crosslinked charge transport layer has a hardened monomer having three or more functional groups without charge transport structure and one with charge transport-containing (meth)acryloyloxy groups RICOH COMPANY, LTD. (JP) 2009-04-14 US disclosed