SCHEMBL10387909

SCHEMBL10387909

COC(=O)CC(C)(C)c1ccc2c(c1)C(=O)c1cc(C(C)(C)CC(=O)OC)ccc1C2=O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 5/20 0.54
▸ RAB9A P51151 5/20 0.54
▸ SMN1; SMN2 Q16637 3/20 0.54
▸ CASP3 P42574 2/20 0.54
▸ SENP8 Q96LD8 2/20 0.54
▸ SENP7 Q9BQF6 2/20 0.54
▸ SENP6 Q9GZR1 2/20 0.54
▸ ATM Q13315 2/20 0.54
▸ LMNA P02545 1/20 0.54
▸ MAPK1 P28482 1/20 0.54
▸ ALDH1A1 P00352 4/20 0.47
▸ PLA2G1B P04054 1/20 0.47
▸ NFKB1 P19838 1/20 0.47
▸ NFKB2 Q00653 1/20 0.47
▸ RELA Q04206 1/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.47
▸ ATG4B Q9Y4P1 1/20 0.47
▸ CNR1 P21554 2/20 0.45
▸ CNR2 P34972 2/20 0.45
▸ PTPRC P08575 6/20 0.41

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
SCHEMBL10387370 1.00 NPC1 (0.54) NPC1RAB9ASMN1; SMN2CASP3SENP8
SCHEMBL10388092 0.96 NPC1 (0.61) NPC1RAB9ASMN1; SMN2CASP3SENP8
SCHEMBL10387345 0.85 NPC1 (0.55) NPC1RAB9ASMN1; SMN2CASP3SENP8
SCHEMBL10387844 0.85 NPC1 (0.51) NPC1RAB9ASMN1; SMN2CASP3SENP8
SCHEMBL10387793 0.85 NPC1 (0.51) NPC1RAB9ASMN1; SMN2CASP3SENP8
SCHEMBL10389038 0.85 NPC1 (0.55) NPC1RAB9ASMN1; SMN2CASP3SENP8
SCHEMBL10387825 0.82 CNR1 (0.59) NPC1RAB9ASMN1; SMN2CASP3SENP8
SCHEMBL10387255 0.82 CNR1 (0.59) NPC1RAB9ASMN1; SMN2CASP3SENP8
SCHEMBL10387906 0.82 RAB9A (0.52) NPC1RAB9ASMN1; SMN2CASP3SENP8
SCHEMBL10388176 0.82 RAB9A (0.52) NPC1RAB9ASMN1; SMN2CASP3SENP8

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-4924015-A PREPARING METALLIC COATINGS AND IMAGES CIBA-GEIGY CORPORATION (US) 1990-05-08 — — US disclosed
EP-0298034-A2 Substituted anthraquinones and their use in epoxy resins CIBA-GEIGY AG (CH) 1989-01-04 — — EP disclosed
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