SCHEMBL2665085

SCHEMBL2665085

Cc1ccc(SCC2CC2)cc1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 1/20 0.51
AR P10275 3/20 0.46
NPC1 O15118 4/20 0.42
RAB9A P51151 4/20 0.42
CTSK P43235 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
ALDH1A1 P00352 2/20 0.41
LMNA P02545 1/20 0.41
HPGD P15428 1/20 0.41
CYP3A4 P08684 1/20 0.40
METAP2 P50579 1/20 0.39
HTT P42858 1/20 0.38
MAPT P10636 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL22315254 0.92 NPC1 (0.47) CRBNARNPC1RAB9ACTSK
SCHEMBL20707943 0.90 NPC1 (0.50) CRBNARNPC1RAB9ACTSK
SCHEMBL5563460 0.87 CRBN (0.49) CRBNARNPC1RAB9ACTSK
SCHEMBL18499513 0.81 CRBN (0.41) CRBNARNPC1RAB9ACTSK
SCHEMBL21161176 0.80 CRBN (0.43) CRBNARNPC1RAB9ACTSK
SCHEMBL5567577 0.79 PRMT3 (0.47) CRBNNPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL24010681 0.78 NPC1 (0.43) ARNPC1RAB9ACTSKSMN1; SMN2
SCHEMBL2054713 0.78 CRBN (0.51) CRBNARRAB9ACTSKSMN1; SMN2
SCHEMBL2665515 0.77 ALDH1A1 (0.50) CRBNARNPC1RAB9AALDH1A1
SCHEMBL20738282 0.76 AR (0.45) CRBNARNPC1RAB9AALDH1A1

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
WO-2003048109-A1 NOVEL GLUCAGON ANTAGONISTS NOVO NORDISK A/S (DK) 2003-06-12 WO disclosed
WO-2002000612-A1 GLUCAGON ANTAGONISTS/INVERSE AGONISTS NOVO NORDISK A/S (DK) 2002-01-03 WO disclosed