SCHEMBL6686431

SCHEMBL6686431

CCOc1ccc(-c2cc3ccc(C)cc3oc2=O)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 9/20 0.59
MIF P14174 2/20 0.58
ADORA3 P0DMS8 2/20 0.56
NPC1 O15118 5/20 0.54
RAB9A P51151 5/20 0.54
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
RXFP1 Q9HBX9 1/20 0.54
SIRT3 Q9NTG7 1/20 0.54
ERAP1 Q9NZ08 1/20 0.54
TP53 P04637 1/20 0.53
MAPT P10636 1/20 0.53
PON1 P27169 1/20 0.52
KDM4E B2RXH2 1/20 0.52
ALDH1A1 P00352 1/20 0.52
GLA P06280 1/20 0.52
GAA P10253 1/20 0.52
HPGD P15428 1/20 0.52
RECQL P46063 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52

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
SCHEMBL10453916 0.85 MAOB (0.80) MAOBMIFADORA3NPC1RAB9A
SCHEMBL18535597 0.85 MAOB (0.62) MAOBMIFNPC1RAB9AMEN1
SCHEMBL10024076 0.84 MIF (0.77) MAOBMIFADORA3RAB9AMEN1
SCHEMBL7123290 0.84 NPC1 (0.74) MAOBMIFADORA3NPC1RAB9A
SCHEMBL7114353 0.83 MIF (0.60) MAOBMIFNPC1RAB9AMEN1
SCHEMBL11753022 0.83 STS (0.58) MIFNPC1RAB9AMEN1KMT2A
SCHEMBL23713498 0.80 RAB9A (0.56) MAOBMIFNPC1RAB9AMEN1
SCHEMBL16520509 0.79 MIF (0.83) MAOBMIFADORA3NPC1RAB9A
SCHEMBL15704421 0.79 MIF (0.65) MAOBMIFADORA3NPC1RAB9A
SCHEMBL12304339 0.79 MAOB (0.77) MAOBMIFADORA3NPC1RAB9A

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-2004089995-A2 PHOTOPOLYMERIZATION SYSTEMS AND THEIR USE ALBEMARLE CORPORATION (US) 2004-10-21 WO disclosed
US-20040198859-A1 Photopolymerization systems and their use NGUYEN CHAU K (US) 2004-10-07 US disclosed