SCHEMBL8664432

SCHEMBL8664432

[c]1occ(-c2ccccc2)c1N1CCOCC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.47
AR P10275 4/20 0.45
HTT P42858 1/20 0.44
HSD17B10 Q99714 3/20 0.43
MAPT P10636 5/20 0.43
ALDH1A1 P00352 3/20 0.43
KDM4E B2RXH2 2/20 0.43
ALOX15 P16050 1/20 0.43
STK4 Q13043 1/20 0.43
STK3 Q13188 1/20 0.43
LRRK2 Q5S007 1/20 0.43
TSHR P16473 2/20 0.42
NPSR1 Q6W5P4 2/20 0.42
PDE4A P27815 1/20 0.42
CASP1 P29466 1/20 0.42
MAPK1 P28482 2/20 0.42
PRKDC P78527 1/20 0.42
HPGD P15428 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
L3MBTL1 Q9Y468 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
SCHEMBL8664979 0.78 NPC1 (0.48) HTTHSD17B10MAPTALDH1A1KDM4E
SCHEMBL8664502 0.74 AR (0.47) LMNAARHTTHSD17B10MAPT
SCHEMBL8663503 0.73 LMNA (0.49) LMNAARHTTHSD17B10MAPT
SCHEMBL15362290 0.72 HTR7 (0.62) LMNAARHTTHSD17B10MAPT
SCHEMBL5133066 0.69 LMNA (0.72) LMNAARHTTHSD17B10MAPT
SCHEMBL254812 0.67 LMNA (0.95) LMNAARHTTHSD17B10MAPT
SCHEMBL3948094 0.67 LMNA (0.95) LMNAARHTTHSD17B10MAPT
SCHEMBL2555823 0.67 LMNA (0.95) LMNAARHTTHSD17B10MAPT
SCHEMBL8664845 0.67 LMNA (0.43) LMNAARHTTHSD17B10MAPT
SCHEMBL8997920 0.66 LMNA (0.42) LMNAARHTTHSD17B10MAPT

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