SCHEMBL24948346

SCHEMBL24948346

BC(=O)OCCOc1cccc2c(=O)c3ccccc3sc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 8/20 0.43
BCL2 P10415 1/20 0.43
BCL2L1 Q07817 1/20 0.43
BAD Q92934 1/20 0.43
ALDH1A1 P00352 3/20 0.39
MAPT P10636 3/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
HCRTR1 O43613 2/20 0.39
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39
CYP19A1 P11511 1/20 0.39
PTPN2 P17706 1/20 0.37
PTPN1 P18031 1/20 0.37
KDM4E B2RXH2 3/20 0.35
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
MAOA P21397 1/20 0.35
MAOB P27338 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
CSF1R P07333 1/20 0.35

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
SCHEMBL11994243 0.85 THRB (0.48) MCL1BCL2BCL2L1BADALDH1A1
SCHEMBL24948345 0.85 MAPT (0.44) MCL1BCL2BCL2L1BADALDH1A1
SCHEMBL10050664 0.83 MCL1 (0.39) MCL1BCL2BCL2L1BADALDH1A1
SCHEMBL8857489 0.81 MAPT (0.43) MCL1BCL2BCL2L1BADALDH1A1
SCHEMBL30998121 0.81 MAPT (0.43) MCL1BCL2BCL2L1BADALDH1A1
SCHEMBL8411604 0.80 PTPN1 (0.54) ALDH1A1MAPTL3MBTL1HCRTR1LMNA
SCHEMBL20465959 0.80 F9 (0.42) MCL1BCL2BCL2L1BADALDH1A1
SCHEMBL21206920 0.78 MAPT (0.44) ALDH1A1MAPTL3MBTL1HCRTR1LMNA
SCHEMBL30998130 0.78 MAPT (0.44) MCL1BCL2BCL2L1BADALDH1A1
SCHEMBL30998122 0.78 MAPT (0.44) MCL1BCL2BCL2L1BADALDH1A1

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
US-20230032881-A1 ACTIVE ENERGY RAY POLYMERIZATION INITIATOR, ACTIVE ENERGY RAY CURING COMPOSITION, ACTIVE ENERGY RAY CURING INK, AQUEOUS ACTIVE ENERGY RAY CURING INK, CONTAINER, IMAGE FORMING DEVICE, IMAGE FORMING METHOD, AND METHOD OF MANUFACTURING ACTIVE ENERGY RAY POLYMERIZATION INITIATOR RICOH COMPANY, LTD. (JP) 2023-02-02 US disclosed