SCHEMBL14985488

SCHEMBL14985488

CCC(C)(C)c1ccc2c(c1)oc1cc(C)ccc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 4/20 0.38
▸ NPC1 O15118 4/20 0.38
▸ RAB9A P51151 3/20 0.38
▸ LMNA P02545 3/20 0.38
▸ MAPK1 P28482 2/20 0.38
▸ MAOB P27338 1/20 0.38
▸ CASP3 P42574 1/20 0.38
▸ ATM Q13315 1/20 0.38
▸ SENP8 Q96LD8 1/20 0.38
▸ SENP7 Q9BQF6 1/20 0.38
▸ SENP6 Q9GZR1 1/20 0.38
▸ CNR2 P34972 3/20 0.38
▸ ALDH1A1 P00352 3/20 0.37
▸ GAA P10253 2/20 0.37
▸ HPGD P15428 1/20 0.37
▸ CDC25A P30304 1/20 0.35
▸ CDC25C P30307 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ MAPT P10636 4/20 0.34
▸ HTT P42858 2/20 0.34

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
SCHEMBL16806105 0.88 SMN1; SMN2 (0.41) SMN1; SMN2NPC1RAB9ALMNAMAPK1
SCHEMBL19676925 0.83 AHR (0.47) SMN1; SMN2NPC1RAB9ALMNAMAPK1
SCHEMBL24730617 0.82 MAOB (0.42) SMN1; SMN2NPC1RAB9ALMNAMAOB
SCHEMBL25490439 0.82 TSHR (0.46) SMN1; SMN2LMNAMAOBALDH1A1GAA
SCHEMBL9927267 0.78 MAOB (0.53) SMN1; SMN2NPC1LMNAMAOBALDH1A1
SCHEMBL16806204 0.77 SMN1; SMN2 (0.41) SMN1; SMN2NPC1RAB9ALMNAMAPK1
SCHEMBL25490441 0.75 MAPT (0.46) SMN1; SMN2NPC1RAB9ALMNAMAOB
SCHEMBL15195120 0.73 MAOB (0.50) SMN1; SMN2NPC1RAB9ALMNAMAOB
SCHEMBL29316506 0.73 NPC1 (0.47) SMN1; SMN2NPC1RAB9ALMNAMAPK1
SCHEMBL16807618 0.72 NPC1 (0.37) SMN1; SMN2NPC1RAB9ALMNAMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130134410-A1 ORGANIC ELECTROLUMINESCENT ELEMENT AND METHOD FOR MANUFACTURING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-05-30 — — US disclosed
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