SCHEMBL10388092

SCHEMBL10388092

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

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 6/20 0.61
▸ RAB9A P51151 6/20 0.61
▸ SMN1; SMN2 Q16637 4/20 0.61
▸ CASP3 P42574 2/20 0.61
▸ SENP8 Q96LD8 2/20 0.61
▸ SENP7 Q9BQF6 2/20 0.61
▸ SENP6 Q9GZR1 2/20 0.61
▸ ATM Q13315 2/20 0.61
▸ LMNA P02545 2/20 0.61
▸ MAPK1 P28482 2/20 0.61
▸ ALDH1A1 P00352 5/20 0.55
▸ L3MBTL1 Q9Y468 2/20 0.55
▸ PLA2G1B P04054 1/20 0.55
▸ NFKB1 P19838 1/20 0.55
▸ NFKB2 Q00653 1/20 0.55
▸ RELA Q04206 1/20 0.55
▸ ATG4B Q9Y4P1 1/20 0.55
▸ PTPRC P08575 7/20 0.45
▸ PTPN13 Q12923 2/20 0.44
▸ MAPT P10636 3/20 0.43

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
SCHEMBL10387909 0.96 NPC1 (0.54) NPC1RAB9ASMN1; SMN2CASP3SENP8
SCHEMBL10387370 0.96 NPC1 (0.54) NPC1RAB9ASMN1; SMN2CASP3SENP8
SCHEMBL10388171 0.86 NPC1 (0.62) NPC1RAB9ASMN1; SMN2CASP3SENP8
SCHEMBL10389122 0.86 NPC1 (0.58) NPC1RAB9ASMN1; SMN2CASP3SENP8
SCHEMBL10388153 0.84 CNR1 (0.56) NPC1RAB9ASMN1; SMN2CASP3SENP8
SCHEMBL10389089 0.84 NPC1 (0.59) NPC1RAB9ASMN1; SMN2CASP3SENP8
SCHEMBL10387852 0.84 NPC1 (0.67) NPC1RAB9ASMN1; SMN2CASP3SENP8
SCHEMBL13528806 0.83 CNR1 (0.61) NPC1RAB9ASMN1; SMN2CASP3SENP8
SCHEMBL10387247 0.82 NPC1 (0.65) NPC1RAB9ASMN1; SMN2CASP3SENP8
SCHEMBL10387285 0.82 NPC1 (0.57) 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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