SCHEMBL14190044

SCHEMBL14190044

Cc1c(-c2ccccc2)sc(-c2ccc(-c3sc(-c4ccc(-c5sc(-c6ccccc6)c(C)c5C)cc4)c(C)c3C)cc2)c1C

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM6 O15303 7/20 0.50
ALOX5 P09917 2/20 0.47
LIMK1 P53667 1/20 0.46
GRM5 P41594 1/20 0.44
MAPT P10636 4/20 0.42
ALDH1A1 P00352 4/20 0.42
GAA P10253 2/20 0.42
HPGD P15428 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
MEN1 O00255 2/20 0.41
LMNA P02545 2/20 0.41
KMT2A Q03164 2/20 0.41
HTT P42858 1/20 0.41
NPC1 O15118 1/20 0.41
TP53 P04637 1/20 0.41
NFKB1 P19838 1/20 0.41
RAB9A P51151 1/20 0.41
NFKB2 Q00653 1/20 0.41
RELA Q04206 1/20 0.41
MAPK1 P28482 1/20 0.41

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
SCHEMBL16996824 0.97 GRM6 (0.52) GRM6ALOX5LIMK1GRM5MAPT
SCHEMBL15591170 0.85 GRM6 (0.41) GRM6ALOX5LIMK1GRM5MAPT
SCHEMBL15591150 0.85 GRM6 (0.41) GRM6ALOX5LIMK1GRM5MAPT
SCHEMBL13713793 0.85 GRM6 (0.47) GRM6ALOX5LIMK1GRM5MAPT
SCHEMBL14832250 0.81 GRM6 (0.44) GRM6ALOX5LIMK1GRM5MAPT
SCHEMBL15060522 0.81 KDM4E (0.47) ALOX5MAPTALDH1A1GAAHPGD
SCHEMBL15591232 0.77 GRM6 (0.38) GRM6ALOX5LIMK1GRM5MAPT
SCHEMBL13125888 0.77 GRM6 (0.38) GRM6ALOX5LIMK1GRM5MAPT
SCHEMBL12262883 0.77 ALOX5 (0.51) GRM6ALOX5MAPTALDH1A1HPGD
SCHEMBL14190040 0.76 ALDH1A1 (0.42) ALOX5MAPTALDH1A1GAAMAPK1

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
US-20080100213-A1 LUMINESCENT DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2008-05-01 US disclosed
US-20080100213-A1 LUMINESCENT DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2008-05-01 US disclosed