SCHEMBL10388173

SCHEMBL10388173

CC(C)(CCCO)c1ccc2c(c1)C(=O)c1ccccc1C2=O

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 6/20 0.65
▸ RAB9A P51151 6/20 0.65
▸ SMN1; SMN2 Q16637 4/20 0.65
▸ LMNA P02545 3/20 0.65
▸ CASP3 P42574 2/20 0.65
▸ SENP8 Q96LD8 2/20 0.65
▸ SENP7 Q9BQF6 2/20 0.65
▸ SENP6 Q9GZR1 2/20 0.65
▸ ATM Q13315 2/20 0.65
▸ MAPK1 P28482 2/20 0.65
▸ ALDH1A1 P00352 4/20 0.58
▸ L3MBTL1 Q9Y468 2/20 0.58
▸ PLA2G1B P04054 1/20 0.58
▸ NFKB1 P19838 1/20 0.58
▸ NFKB2 Q00653 1/20 0.58
▸ RELA Q04206 1/20 0.58
▸ ATG4B Q9Y4P1 1/20 0.58
▸ CNR1 P21554 7/20 0.52
▸ CNR2 P34972 7/20 0.52
▸ MAPT P10636 4/20 0.42

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
SCHEMBL10387261 0.98 NPC1 (0.63) NPC1RAB9ASMN1; SMN2LMNACASP3
SCHEMBL10387824 0.94 CNR1 (0.56) NPC1RAB9ASMN1; SMN2LMNACASP3
SCHEMBL10388169 0.94 CNR1 (0.56) NPC1RAB9ASMN1; SMN2LMNACASP3
SCHEMBL10388154 0.91 NPC1 (0.69) NPC1RAB9ASMN1; SMN2LMNACASP3
SCHEMBL10386721 0.88 NPC1 (0.57) NPC1RAB9ASMN1; SMN2LMNACASP3
SCHEMBL10388166 0.85 NPC1 (0.60) NPC1RAB9ASMN1; SMN2LMNACASP3
SCHEMBL10387245 0.85 NPC1 (0.60) NPC1RAB9ASMN1; SMN2LMNACASP3
SCHEMBL10389123 0.84 NPC1 (0.60) NPC1RAB9ASMN1; SMN2LMNACASP3
SCHEMBL10387790 0.84 NPC1 (0.60) NPC1RAB9ASMN1; SMN2LMNACASP3
SCHEMBL10389058 0.84 NPC1 (0.60) NPC1RAB9ASMN1; SMN2LMNACASP3

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
Send feedback