SCHEMBL1238396

SCHEMBL1238396

Cc1cccc(-c2ccc(C(C)(C)c3cccs3)o2)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 6/20 0.54
CNR2 P34972 6/20 0.54
SLC9A1 P19634 2/20 0.38
MAPT P10636 4/20 0.38
ALDH1A1 P00352 3/20 0.38
HPGD P15428 4/20 0.35
KDM4E B2RXH2 4/20 0.35
TP53 P04637 2/20 0.35
CYP3A4 P08684 2/20 0.35
MAPK1 P28482 2/20 0.35
HSD17B10 Q99714 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
TSHR P16473 1/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
HTT P42858 1/20 0.34
NPSR1 Q6W5P4 1/20 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
SCHEMBL12529434 0.78 SLC9A1 (0.46) CNR1CNR2SLC9A1MAPTALDH1A1
SCHEMBL1205269 0.70 CNR2 (1.00) CNR1CNR2ALDH1A1HPGDKDM4E
SCHEMBL3223353 0.68 CNR1 (0.65) CNR1CNR2MAPTALDH1A1HPGD
SCHEMBL24818370 0.67 HPGD (0.56) SLC9A1MAPTALDH1A1HPGDKDM4E
SCHEMBL30938674 0.67 HPGD (0.56) SLC9A1MAPTALDH1A1HPGDKDM4E
SCHEMBL153096 0.67 PRMT6 (0.54) CNR1CNR2MAPTALDH1A1HPGD
SCHEMBL12266933 0.67 SLC9A1 (0.50) SLC9A1MAPTALDH1A1HPGDKDM4E
SCHEMBL1206595 0.67 CNR1 (0.56) CNR1CNR2ALDH1A1HPGDTP53
SCHEMBL1491152 0.66 CNR2 (0.68) CNR1CNR2MAPTALDH1A1HPGD
SCHEMBL13706022 0.66 CNR1 (0.47) CNR1CNR2ALDH1A1HSD17B10NPC1

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
WO-2011022694-A2 FURANOPYRIMIDINE CANNABINOID COMPOUNDS AND RELATED METHODS OF USE UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION, THE (US) 2011-02-24 WO disclosed