SCHEMBL8664016

SCHEMBL8664016

Brc1cs[c]c1-c1ccccc1N1CCOCC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.43
MEN1 O00255 3/20 0.43
MAPT P10636 3/20 0.43
NPC1 O15118 3/20 0.43
RAB9A P51151 3/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
TDP1 Q9NUW8 1/20 0.43
NPSR1 Q6W5P4 2/20 0.39
GAA P10253 1/20 0.39
HSD17B10 Q99714 2/20 0.39
ALOX15 P16050 1/20 0.39
LMNA P02545 2/20 0.37
NSD2 O96028 2/20 0.37
ALDH1A1 P00352 2/20 0.37
HPGD P15428 2/20 0.37
KDM4E B2RXH2 1/20 0.37
AR P10275 1/20 0.36
EPHX2 P34913 1/20 0.36
TSHR P16473 1/20 0.36
MAPK10 P53779 1/20 0.36

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
SCHEMBL8997930 0.83 MAPT (0.43) KMT2AMEN1MAPTNPC1RAB9A
SCHEMBL8664832 0.82 HTR2A (0.43) KMT2AMEN1MAPTNPC1RAB9A
SCHEMBL8665476 0.78 ALDH1A1 (0.43) KMT2AMEN1MAPTNPC1RAB9A
SCHEMBL8663809 0.76 KMT2A (0.43) KMT2AMEN1MAPTNPC1RAB9A
SCHEMBL8997879 0.76 MAPT (0.43) KMT2AMEN1MAPTNPC1RAB9A
SCHEMBL17628666 0.71 NPC1 (0.44) KMT2AMEN1MAPTNPC1RAB9A
SCHEMBL136220 0.71 LMNA (0.52) KMT2AMEN1MAPTNPC1RAB9A
SCHEMBL30719587 0.71 LMNA (0.52) KMT2AMEN1MAPTNPC1RAB9A
SCHEMBL8666226 0.70 NPC1 (0.41) KMT2AMEN1MAPTNPC1RAB9A
SCHEMBL8663997 0.70 KMT2A (0.46) KMT2AMEN1MAPTNPC1RAB9A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5852006-A N-aminoalkyl-substituted nitrogen-containing six membered heterocyclic compounds NIPPON CHEMIPHAR CO., LTD. (JP) 1998-12-22 US disclosed
US-5574030-A INHIBITING URINARY CONTRACTION, HETEROCYCLIC DIAMINES NIPPON CHEMIPHAR CO., LTD. (JP) 1996-11-12 US disclosed