SCHEMBL9544162

SCHEMBL9544162

O=C(O)C(=O)Nc1ccccc1Cc1ccccc1

nearest known ligand 0.66

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.66
ALDH1A1 P00352 4/20 0.50
HPGD P15428 1/20 0.50
GPR35 Q9HC97 1/20 0.50
MAOB P27338 1/20 0.49
LMNA P02545 2/20 0.49
HTT P42858 2/20 0.49
PKM P14618 1/20 0.48
MEN1 O00255 1/20 0.44
POLB P06746 1/20 0.44
MAPT P10636 1/20 0.44
RECQL P46063 1/20 0.44
KMT2A Q03164 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
MCOLN3 Q8TDD5 1/20 0.44
KDM4E B2RXH2 1/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44

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
SCHEMBL4172605 0.85 L3MBTL1 (0.70) L3MBTL1ALDH1A1HPGDMAOBLMNA
SCHEMBL2419022 0.84 L3MBTL1 (0.68) L3MBTL1ALDH1A1HPGDMAOBLMNA
SCHEMBL27547012 0.84 L3MBTL1 (0.68) L3MBTL1ALDH1A1HPGDMAOBLMNA
Hydrochloric Acid SCHEMBL11164652 0.84 L3MBTL1 (0.68) L3MBTL1ALDH1A1HPGDMAOBLMNA
SCHEMBL7522410 0.82 L3MBTL1 (0.71) L3MBTL1ALDH1A1HPGDMAOBLMNA
SCHEMBL2814913 0.82 L3MBTL1 (0.66) L3MBTL1ALDH1A1HPGDMAOBLMNA
SCHEMBL21551505 0.81 MAPT (0.60) L3MBTL1ALDH1A1GPR35LMNAHTT
SCHEMBL21504754 0.81 L3MBTL1 (0.73) L3MBTL1ALDH1A1HPGDMAOBLMNA
SCHEMBL10690887 0.81 L3MBTL1 (0.64) L3MBTL1ALDH1A1HPGDMAOBLMNA
SCHEMBL22966593 0.79 L3MBTL1 (0.62) L3MBTL1ALDH1A1HPGDMAOBLMNA

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
WO-1993008823-A1 GUANIDINYL AND RELATED CELL ADHESION MODULATION COMPOUNDS TANABE SEIYAKU CO., LTD. (JP) 1993-05-13 WO disclosed