SCHEMBL17847704

SCHEMBL17847704

Fc1ccc(C2CCCS2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.39
KDM1A O60341 2/20 0.38
TP53 P04637 1/20 0.35
GAA P10253 1/20 0.35
MAPK1 P28482 1/20 0.35
SLC6A2 P23975 2/20 0.33
HTR2A P28223 2/20 0.33
HTR2C P28335 2/20 0.33
SLC6A4 P31645 2/20 0.33
HTR2B P41595 2/20 0.33
SLC6A3 Q01959 2/20 0.33
LIG1 P18858 1/20 0.33
TRPA1 O75762 1/20 0.33
TDP1 Q9NUW8 1/20 0.32
MEN1 O00255 1/20 0.32
LMNA P02545 1/20 0.32
KMT2A Q03164 1/20 0.32
MAOA P21397 1/20 0.32
HTR7 P34969 1/20 0.31
TGFBR1 P36897 1/20 0.31

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
SCHEMBL9358742 0.79 MAPT (0.44) ATMTP53SLC6A2HTR2AHTR2C
SCHEMBL2951171 0.78 BRD4 (0.43) GAAMAOA
SCHEMBL19952963 0.76 PTGS1 (0.33)
SCHEMBL28532517 0.75 BRD4 (0.32)
SCHEMBL11180254 0.75 CYP1A2 (0.38) TP53TDP1LMNAMAOATGFBR1
SCHEMBL2114415 0.75 KDM1A (0.44) ATMKDM1ATP53GAAMAPK1
SCHEMBL14322816 0.75 SLC6A2 (0.38) GAASLC6A2SLC6A4SLC6A3LMNA
SCHEMBL9359327 0.75 MAOA (0.58) KDM1ASLC6A2SLC6A4SLC6A3KMT2A
SCHEMBL11321745 0.75 TRIM24 (0.36)
SCHEMBL6694368 0.74 NPC1 (0.44) ATMKDM1AMAPK1SLC6A2HTR2A

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
CN-119372738-A Aluminum material with surface covered with nano aluminum oxide layer, and preparation method and application thereof 南京大学 2025-01-28 CN disclosed
WO-2016098016-A1 PROCESS FOR THE PREPARATION OF SGLT2 INHIBITORS DR. REDDY’S LABORATORIES LIMITED (IN) 2016-06-23 WO disclosed