SCHEMBL28585693

SCHEMBL28585693

O=c1c2c(sc3ccccc13)C=CCC2=S

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.36
GPR3 P46089 1/20 0.34
MAPT P10636 8/20 0.34
ALDH1A1 P00352 7/20 0.34
NPC1 O15118 3/20 0.34
RAB9A P51151 3/20 0.34
TDP1 Q9NUW8 3/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
MAOA P21397 1/20 0.34
MAOB P27338 1/20 0.34
POLB P06746 4/20 0.33
MEN1 O00255 4/20 0.33
KMT2A Q03164 4/20 0.33
LMNA P02545 3/20 0.33
BLM P54132 2/20 0.33
MAPK1 P28482 1/20 0.33
RECQL P46063 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
SAE1 Q9UBE0 1/20 0.33
UBA2 Q9UBT2 1/20 0.33

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
SCHEMBL5341185 0.84 KDM4E (0.38) KDM4EGPR3MAPTALDH1A1NPC1
SCHEMBL7427769 0.78 GPR3 (0.39) KDM4EGPR3MAPTALDH1A1NPC1
SCHEMBL4324161 0.70 GPR3 (0.44) KDM4EGPR3MAPTALDH1A1RAB9A
SCHEMBL19674661 0.69 KDM4E (0.38) KDM4EGPR3MAPTALDH1A1NPC1
SCHEMBL28347436 0.68 MAPT (0.33) KDM4EGPR3MAPTALDH1A1NPC1
SCHEMBL3345558 0.68 MAOA (0.47) KDM4EMAPTALDH1A1NPC1RAB9A
SCHEMBL4869891 0.66 KDM4E (0.38) KDM4EGPR3MAPTALDH1A1NPC1
SCHEMBL9160474 0.66 GPR3 (0.68) KDM4EGPR3MAPTALDH1A1NPC1
SCHEMBL29374932 0.66 GPR3 (0.68) KDM4EGPR3MAPTALDH1A1NPC1
SCHEMBL4696033 0.66 GPR3 (0.68) KDM4EGPR3MAPTALDH1A1NPC1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113075862-A Etch resistant composition 长春人造树脂厂股份有限公司 2021-07-06 CN disclosed