SCHEMBL28601348

SCHEMBL28601348

CCC(=O)c1ccc(C=Cc2ccc(C)cc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.56
GSK3B P49841 1/20 0.52
MAOB P27338 4/20 0.50
RAB9A P51151 4/20 0.50
MAOA P21397 3/20 0.50
POLB P06746 1/20 0.50
KMT2A Q03164 5/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
MEN1 O00255 3/20 0.48
NPC1 O15118 2/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
ALDH1A1 P00352 4/20 0.47
HPGD P15428 2/20 0.47
CYP1B1 Q16678 2/20 0.47
CYP3A4 P08684 1/20 0.47
PKM P14618 2/20 0.45
HTT P42858 2/20 0.45
ATM Q13315 2/20 0.45
NPSR1 Q6W5P4 2/20 0.45
LMNA P02545 2/20 0.45

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
SCHEMBL507067 0.88 GSK3B (0.64) MAPTGSK3BRAB9AKMT2ASMN1; SMN2
Hydrochloric Acid SCHEMBL30478406 0.86 GSK3B (0.61) MAPTGSK3BRAB9AKMT2ASMN1; SMN2
SCHEMBL17151321 0.85 L3MBTL1 (0.48) MAPTMAOBRAB9AKMT2ASMN1; SMN2
SCHEMBL9342342 0.83 GSK3B (0.52) MAPTGSK3BMAOBMAOAPOLB
SCHEMBL27864946 0.82 MAPT (0.50) MAPTMAOBRAB9AKMT2ASMN1; SMN2
SCHEMBL2633141 0.82 SMN1; SMN2 (0.70) MAPTGSK3BRAB9AKMT2ASMN1; SMN2
SCHEMBL19076171 0.81 HDAC1 (0.59) MAPTRAB9AKMT2ASMN1; SMN2MEN1
SCHEMBL22548920 0.80 MAPT (0.44) MAPTRAB9AKMT2ASMN1; SMN2MEN1
SCHEMBL8578037 0.79 MAPT (0.55) MAPTGSK3BRAB9APOLBKMT2A
SCHEMBL9717512 0.79 MAPT (0.55) MAPTGSK3BMAOBRAB9AMAOA

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-112409550-B Preparation and application of LED sensitive distyryl oxime ester type water-soluble photoinitiator 同济大学 2021-09-14 CN disclosed
CN-112409550-A Preparation and application of LED sensitive distyryl oxime ester type water-soluble photoinitiator 同济大学 2021-02-26 CN disclosed