SCHEMBL15315657

SCHEMBL15315657

O=C1CCCCC1Sc1cccc(CO)c1

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 9/20 0.61
CRBN Q96SW2 9/20 0.61
ALDH1A1 P00352 3/20 0.41
MAPT P10636 1/20 0.41
NPC1 O15118 3/20 0.40
RAB9A P51151 3/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
CHRNB4 P30926 2/20 0.37
CHRNA3 P32297 2/20 0.37
CHRNA7 P36544 1/20 0.37
ALOX5 P09917 1/20 0.36
USP2 O75604 1/20 0.36
POLB P06746 1/20 0.36
TSHR P16473 1/20 0.36
HSD17B10 Q99714 1/20 0.36
CYP3A4 P08684 1/20 0.35
GAA P10253 1/20 0.35
CYP2C19 P33261 1/20 0.35

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
SCHEMBL15318109 0.78 DDB1 (0.58) DDB1CRBNALDH1A1MAPTNPC1
SCHEMBL15315654 0.78 DDB1 (0.58) DDB1CRBNALDH1A1MAPTNPC1
SCHEMBL15315662 0.78 DDB1 (0.58) DDB1CRBNALDH1A1MAPTNPC1
SCHEMBL925026 0.77 DDB1 (0.52) DDB1CRBNCHRNB4CHRNA3CHRNA7
SCHEMBL809509 0.77 ALDH1A1 (0.54) DDB1CRBNALDH1A1MAPTNPC1
SCHEMBL2946543 0.77 ALDH1A1 (0.54) DDB1CRBNALDH1A1MAPTNPC1
SCHEMBL22612086 0.76 DDB1 (1.00) DDB1CRBN
SCHEMBL15318104 0.75 DDB1 (0.61) DDB1CRBNALDH1A1MAPTNPC1
SCHEMBL30288394 0.74 DDB1 (0.55) DDB1CRBNCHRNB4CHRNA3CHRNA7
SCHEMBL19277423 0.74 DDB1 (0.55) DDB1CRBNCHRNB4CHRNA3CHRNA7

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-20130270530-A1 ORGANIC ELECTROLUMINESCENT ELEMENT AND COMPOUND UDC IRELAND LIMITED (IE) 2013-10-17 US disclosed