SCHEMBL8059103

SCHEMBL8059103

COC(=O)Cc1ccc(N(c2ccc(C)c(C)c2)c2ccc(-c3ccc(N(c4ccc(CC(=O)OC)cc4)c4ccc(C)c(C)c4)c(C)c3)cc2C)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.48
NPC1 O15118 2/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
CYP4F2 P78329 1/20 0.40
CYP4A11 Q02928 1/20 0.40
ALDH1A1 P00352 5/20 0.37
GAA P10253 1/20 0.37
GFER P55789 1/20 0.37
HSP90AB1 P08238 1/20 0.36
GPR88 Q9GZN0 1/20 0.36
MCL1 Q07820 1/20 0.36
CYP11B1 P15538 1/20 0.36
CYP11B2 P19099 1/20 0.36
HSD17B1 P14061 1/20 0.35
HSD17B2 P37059 1/20 0.35
LMNA P02545 2/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
MAPK1 P28482 1/20 0.35
SIRT5 Q9NXA8 1/20 0.35

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
SCHEMBL2810605 0.88 GPR88 (0.38) RAB9ANPC1SMN1; SMN2CYP4F2CYP4A11
SCHEMBL8013965 0.88 GPR88 (0.38) RAB9ANPC1SMN1; SMN2CYP4F2CYP4A11
SCHEMBL15214884 0.85 SMN1; SMN2 (0.36) RAB9ANPC1SMN1; SMN2ALDH1A1GAA
SCHEMBL279012 0.83 SMN1; SMN2 (0.33) RAB9ANPC1SMN1; SMN2MCL1
SCHEMBL279030 0.83 ALDH1A1 (0.36) RAB9ANPC1SMN1; SMN2ALDH1A1GAA
SCHEMBL14732626 0.82 GPR88 (0.37) RAB9ANPC1SMN1; SMN2CYP4F2CYP4A11
SCHEMBL279250 0.82 MGLL (0.48) RAB9ANPC1SMN1; SMN2
SCHEMBL10092986 0.82 SMN1; SMN2 (0.34) RAB9ANPC1SMN1; SMN2ALDH1A1GAA
SCHEMBL279187 0.81 MAPT (0.35) SMN1; SMN2ALDH1A1MCL1HSD17B1HSD17B2
SCHEMBL14733280 0.81 CYP4F2 (0.41) CYP4F2CYP4A11ALDH1A1GPR88

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0686879-B1 Charge-transporting polymer and organic electronic device using the same FUJI XEROX CO LTD (JP) 2000-05-24 EP disclosed
US-5604064-A USEFUL IN ELECTROPHOTOGRAPHIC PHOTORECEPTORS FUJI XEROX CO., LTD. (JP) 1997-02-18 US disclosed
EP-0686879-A1 Charge-transporting polymer and organic electronic device using the same FUJI XEROX CO., LTD. (JP) 1995-12-13 EP disclosed