SCHEMBL7307640

SCHEMBL7307640

O=C(O)C1CCN(C(=O)/C=C/c2ccccc2Cl)C1

nearest known ligand 0.63

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.63
L3MBTL1 Q9Y468 1/20 0.63
POLB P06746 2/20 0.60
F2R P25116 2/20 0.57
LMNA P02545 1/20 0.54
ITGAL P20701 4/20 0.53
NOTUM Q6P988 2/20 0.51
RAB9A P51151 5/20 0.50
NPC1 O15118 4/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
ITGB2 P05107 3/20 0.49
ICAM1 P05362 3/20 0.49
HPGD P15428 1/20 0.49
KDM4E B2RXH2 1/20 0.46

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
SCHEMBL7307644 1.00 MAPT (0.63) MAPTL3MBTL1POLBF2RLMNA
SCHEMBL7307935 0.92 MAPT (0.67) MAPTL3MBTL1POLBF2RLMNA
SCHEMBL7307943 0.92 MAPT (0.67) MAPTL3MBTL1POLBF2RLMNA
SCHEMBL7313994 0.92 MAPT (0.70) MAPTL3MBTL1POLBF2RLMNA
SCHEMBL7313986 0.92 MAPT (0.70) MAPTL3MBTL1POLBF2RLMNA
SCHEMBL7309311 0.91 MAPT (0.66) MAPTL3MBTL1POLBF2RLMNA
SCHEMBL7309304 0.91 MAPT (0.66) MAPTL3MBTL1POLBF2RLMNA
SCHEMBL7303644 0.87 L3MBTL1 (0.71) MAPTL3MBTL1POLBF2RLMNA
SCHEMBL7303641 0.87 L3MBTL1 (0.71) MAPTL3MBTL1POLBF2RLMNA
SCHEMBL7301194 0.83 RAB9A (0.68) MAPTPOLBLMNARAB9ANPC1

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
EP-0520336-A2 Aldehyde derivatives and their use as calpain inhibitors FUJIREBIO Inc. (JP) 1992-12-30 EP disclosed