SCHEMBL4066925

SCHEMBL4066925

CC(C)c1cc(-c2ccc(F)c(C(=O)Nc3ccccc3)c2)c(O)cc1O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCL2 P10415 1/20 0.52
TMPRSS4 Q9NRS4 1/20 0.46
MEN1 O00255 4/20 0.44
KMT2A Q03164 4/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
TP53 P04637 3/20 0.43
LMNA P02545 3/20 0.43
HTT P42858 2/20 0.43
TDP1 Q9NUW8 1/20 0.43
KDM4E B2RXH2 1/20 0.43
HPGD P15428 1/20 0.43
HSD17B10 Q99714 1/20 0.43
MAPT P10636 1/20 0.42
GAA P10253 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
ALDH1A1 P00352 1/20 0.41
KCNK3 O14649 3/20 0.41
KCNK9 Q9NPC2 3/20 0.41
CHRNB2 P17787 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
SCHEMBL13848298 0.83 KCNA3 (0.42) MEN1KMT2AHTTKDM4EHPGD
SCHEMBL4069860 0.82 ACMSD (0.48) MEN1KMT2ALMNAKDM4EHPGD
SCHEMBL13848474 0.82 KCNK3 (0.51) BCL2MEN1KMT2ANPC1RAB9A
SCHEMBL21644634 0.80 BCL2 (0.69) BCL2TMPRSS4MEN1KMT2ANPC1
SCHEMBL5786347 0.77 KAT6A (0.58) MEN1KMT2ANPC1RAB9ATP53
SCHEMBL4060757 0.74 HSP90AA1 (0.43) LMNA
SCHEMBL21644546 0.72 P2RX1 (0.56) BCL2MEN1KMT2ANPC1RAB9A
SCHEMBL10586949 0.72 BCL2 (0.69) BCL2MEN1KMT2ATP53LMNA
SCHEMBL21644609 0.72 SMN1; SMN2 (0.54) BCL2MEN1KMT2ANPC1RAB9A
SCHEMBL4069702 0.71 HSP90AA1 (0.44) LMNA

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-2009066060-A2 4-SUBSTITUTED-6-ISOPROPYL-BENZENE-1,3-DIOL COMPOUNDS AND THEIR USE TOPOTARGET A/S (DK) 2009-05-28 WO disclosed
WO-2009066060-A2 4-SUBSTITUTED-6-ISOPROPYL-BENZENE-1,3-DIOL COMPOUNDS AND THEIR USE TOPOTARGET A/S (DK) 2009-05-28 WO disclosed