SCHEMBL10387903

SCHEMBL10387903

COC(=O)CC(C)CCCC(C)(C)c1ccc2c(c1)C(=O)c1ccccc1C2=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 5/20 0.51
▸ RAB9A P51151 5/20 0.51
▸ SMN1; SMN2 Q16637 3/20 0.51
▸ CASP3 P42574 2/20 0.51
▸ SENP8 Q96LD8 2/20 0.51
▸ SENP7 Q9BQF6 2/20 0.51
▸ SENP6 Q9GZR1 2/20 0.51
▸ ATM Q13315 2/20 0.51
▸ LMNA P02545 1/20 0.51
▸ MAPK1 P28482 1/20 0.51
▸ ALDH1A1 P00352 4/20 0.46
▸ PLA2G1B P04054 1/20 0.46
▸ NFKB1 P19838 1/20 0.46
▸ NFKB2 Q00653 1/20 0.46
▸ RELA Q04206 1/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ ATG4B Q9Y4P1 1/20 0.46
▸ CNR1 P21554 5/20 0.44
▸ CNR2 P34972 5/20 0.44
▸ 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
SCHEMBL10388174 0.96 CNR1 (0.46) NPC1RAB9ASMN1; SMN2CASP3SENP8
SCHEMBL10388094 0.96 CNR1 (0.46) NPC1RAB9ASMN1; SMN2CASP3SENP8
SCHEMBL10387816 0.93 NPC1 (0.46) NPC1RAB9ASMN1; SMN2CASP3SENP8
SCHEMBL10387787 0.93 NPC1 (0.46) NPC1RAB9ASMN1; SMN2CASP3SENP8
SCHEMBL10387374 0.90 NPC1 (0.50) NPC1RAB9ASMN1; SMN2CASP3SENP8
SCHEMBL10387827 0.89 NPC1 (0.52) NPC1RAB9ASMN1; SMN2CASP3SENP8
SCHEMBL10389087 0.87 NPC1 (0.55) NPC1RAB9ASMN1; SMN2CASP3SENP8
SCHEMBL10388144 0.87 NPC1 (0.50) NPC1RAB9ASMN1; SMN2CASP3SENP8
SCHEMBL10388180 0.86 NPC1 (0.49) NPC1RAB9ASMN1; SMN2CASP3SENP8
SCHEMBL10387865 0.86 NPC1 (0.53) 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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