SCHEMBL7919239

SCHEMBL7919239

N#CCC(=O)NC(=O)N(Cc1ccccc1)Cc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 1/20 0.55
ALDH1A1 P00352 3/20 0.53
NPSR1 Q6W5P4 1/20 0.53
POLB P06746 2/20 0.52
CTSS P25774 5/20 0.51
CTSL P07711 3/20 0.51
CTSK P43235 2/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
HDAC1 Q13547 2/20 0.43
SNCA P37840 1/20 0.43
GAA P10253 1/20 0.43
LMNA P02545 1/20 0.42
RECQL P46063 1/20 0.42

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
SCHEMBL8749389 0.78 POLB (0.51) MCL1ALDH1A1NPSR1POLBCTSS
SCHEMBL4471126 0.77 MCL1 (0.62) MCL1ALDH1A1CTSSCTSLMEN1
SCHEMBL3067377 0.75 ALDH1A1 (0.61) ALDH1A1NPSR1MEN1KMT2ATDP1
SCHEMBL4486916 0.74 MCL1 (0.58) MCL1ALDH1A1POLBCTSSMEN1
SCHEMBL16751795 0.73 POLB (0.53) ALDH1A1NPSR1POLBCTSSCTSL
SCHEMBL22803097 0.72 ALDH1A1 (0.52) MCL1ALDH1A1POLBCTSSCTSL
SCHEMBL4481569 0.71 MCL1 (0.54) MCL1ALDH1A1NPSR1MEN1KMT2A
SCHEMBL654148 0.71 MCL1 (1.00) MCL1ALDH1A1MEN1KMT2AGAA
SCHEMBL19027679 0.71 ALDH1A1 (0.65) ALDH1A1NPSR1MEN1KMT2ALMNA
SCHEMBL9142127 0.70 MCL1 (0.62) MCL1ALDH1A1POLBCTSSCTSL

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-6211270-B1 HEAT AND LIGHT STABILIZERS FOR POLYMERS WITCO VINYL ADDITIVES GMBH (DE) 2001-04-03 US disclosed