SCHEMBL25328345

SCHEMBL25328345

COc1ccc(-c2csc(-n3nc(-c4cccc(OC)c4)cc3O)n2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 3/20 0.54
MMP8 P22894 3/20 0.54
MAPT P10636 4/20 0.52
LMNA P02545 3/20 0.52
HTT P42858 3/20 0.52
SMN1; SMN2 Q16637 3/20 0.52
ALDH1A1 P00352 3/20 0.52
MAPK1 P28482 2/20 0.52
TP53 P04637 1/20 0.52
GAA P10253 1/20 0.52
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
NPC1 O15118 3/20 0.49
RAB9A P51151 3/20 0.49
HPGD P15428 2/20 0.48
HSD17B10 Q99714 2/20 0.48
AR P10275 1/20 0.48
ATP4A P20648 1/20 0.48
ATP4B P51164 1/20 0.48
PTGER1 P34995 1/20 0.48

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
SCHEMBL25328215 0.94 MAPT (0.54) MMP2MMP8MAPTLMNAHTT
SCHEMBL30118314 0.86 MAPT (0.55) MMP2MMP8MAPTLMNAHTT
SCHEMBL28911459 0.86 MAPT (0.55) MMP2MMP8MAPTLMNAHTT
SCHEMBL25917257 0.83 SIRT5 (0.55) MAPTLMNASMN1; SMN2ALDH1A1MAPK1
SCHEMBL28911458 0.82 RAB9A (0.55) MAPTLMNASMN1; SMN2ALDH1A1MAPK1
SCHEMBL25329191 0.80 RAB9A (0.59) MMP2MMP8MAPTLMNAHTT
SCHEMBL17900391 0.79 PTGER1 (0.74) ALDH1A1MEN1KMT2ANPC1RAB9A
SCHEMBL25916900 0.78 RAB9A (0.54) MAPTLMNASMN1; SMN2ALDH1A1MAPK1
SCHEMBL25916891 0.77 RAB9A (0.55) MAPTALDH1A1MEN1KMT2ANPC1
SCHEMBL25917129 0.76 KMT2A (0.53) MAPTSMN1; SMN2ALDH1A1MEN1KMT2A

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-2023141262-A1 BAX ACTIVATORS AND USE THEREOF IPSEN PHARMA S.A.S. (FR) 2023-07-27 WO disclosed
WO-2023141262-A1 BAX ACTIVATORS AND USE THEREOF IPSEN PHARMA S.A.S. (FR) 2023-07-27 WO disclosed