SCHEMBL8566843

SCHEMBL8566843

CCn1nccc1C(=O)N(C)C

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.49
MEN1 O00255 3/20 0.49
ALDH1A1 P00352 3/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
MAPT P10636 2/20 0.49
NPSR1 Q6W5P4 2/20 0.49
HPGD P15428 1/20 0.49
RAB9A P51151 3/20 0.48
NPC1 O15118 2/20 0.48
HTT P42858 2/20 0.47
L3MBTL1 Q9Y468 2/20 0.46
MAPK1 P28482 1/20 0.38
LMNA P02545 1/20 0.37
SLC13A5 Q86YT5 1/20 0.36
CYP2D6 P10635 1/20 0.36
POLB P06746 1/20 0.35
FLT1 P17948 1/20 0.35
KDR P35968 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
SCHEMBL3573767 0.83 L3MBTL1 (0.48) KMT2AMEN1ALDH1A1SMN1; SMN2MAPT
SCHEMBL336115 0.79 KMT2A (0.53) KMT2AMEN1ALDH1A1SMN1; SMN2MAPT
SCHEMBL262196 0.79 MEN1 (0.53) KMT2AMEN1ALDH1A1SMN1; SMN2MAPT
SCHEMBL25457901 0.79 FLT1 (0.38) KMT2AALDH1A1RAB9ANPC1L3MBTL1
SCHEMBL16963334 0.78 KMT2A (0.55) KMT2AMEN1ALDH1A1SMN1; SMN2MAPT
SCHEMBL2660301 0.78 MEN1 (0.51) KMT2AMEN1ALDH1A1SMN1; SMN2MAPT
SCHEMBL29530824 0.77 KMT2A (0.37) KMT2AMEN1ALDH1A1SMN1; SMN2MAPT
SCHEMBL31460254 0.77 MAPK1 (0.35) KMT2AMEN1ALDH1A1SMN1; SMN2MAPT
SCHEMBL29158106 0.76 KMT2A (0.50) KMT2AMEN1ALDH1A1SMN1; SMN2MAPT
SCHEMBL31460107 0.76 PIK3CD (0.37) KMT2AMEN1ALDH1A1SMN1; SMN2MAPT

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-5846990-A Substituted biphenyl isoxazole sulfonamides BRISTOL-MYERS SQUIBB CO. (US) 1998-12-08 US claimed