SCHEMBL14407952

SCHEMBL14407952

CC(=O)c1ccc(Oc2ccc(Sc3ccc(Oc4ccc(C(=O)c5ccc(C(=O)c6ccc(F)cc6)cc5)cc4)cc3)cc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.58
L3MBTL1 Q9Y468 3/20 0.58
MAPT P10636 2/20 0.58
LMNA P02545 2/20 0.58
RAB9A P51151 1/20 0.58
ALDH1A1 P00352 4/20 0.51
MAOB P27338 3/20 0.50
BACE1 P56817 1/20 0.44
SRD5A2 P31213 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
ESRRA P11474 1/20 0.41
HTT P42858 1/20 0.41
LTA4H P09960 1/20 0.41
KDM4E B2RXH2 1/20 0.41
GAA P10253 2/20 0.40
MEN1 O00255 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL14407951 0.92 SRD5A2 (0.49) HPGDL3MBTL1MAPTLMNARAB9A
SCHEMBL14407944 0.86 HPGD (0.59) HPGDL3MBTL1MAPTLMNARAB9A
SCHEMBL3370005 0.85 HPGD (0.79) HPGDL3MBTL1MAPTLMNARAB9A
SCHEMBL3138940 0.85 HPGD (0.79) HPGDL3MBTL1MAPTLMNARAB9A
SCHEMBL8429008 0.82 LTA4H (0.57) HPGDL3MBTL1MAPTLMNARAB9A
SCHEMBL2862520 0.82 SRD5A2 (0.59) HPGDMAPTLMNARAB9AALDH1A1
SCHEMBL28319232 0.82 SRD5A2 (0.59) HPGDMAPTLMNARAB9AALDH1A1
SCHEMBL3020544 0.82 SRD5A2 (0.59) HPGDMAPTLMNARAB9AALDH1A1
SCHEMBL15448720 0.82 SRD5A2 (0.59) HPGDMAPTLMNARAB9AALDH1A1
SCHEMBL14407934 0.81 SRD5A2 (0.46) HPGDALDH1A1SRD5A2KDM4EGAA

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-7265196-B2 Controlled crosslinked polyaryletherketone material with improved properties and a process by producing the same JILIN UNIVERSITY (CN) 2007-09-04 US disclosed
US-7265196-B2 Controlled crosslinked polyaryletherketone material with improved properties and a process by producing the same JILIN UNIVERSITY (CN) 2007-09-04 US disclosed