SCHEMBL8664845

SCHEMBL8664845

[c]1ccc(-c2ccccc2)c(N2CCOCC2)c1-c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.43
AR P10275 2/20 0.42
HTT P42858 2/20 0.41
HSD17B10 Q99714 4/20 0.41
ALDH1A1 P00352 5/20 0.40
KDM4E B2RXH2 4/20 0.40
HPGD P15428 3/20 0.40
ALOX15 P16050 2/20 0.40
STK4 Q13043 1/20 0.40
STK3 Q13188 1/20 0.40
LRRK2 Q5S007 1/20 0.40
GAA P10253 1/20 0.40
MAPT P10636 2/20 0.39
PRKDC P78527 2/20 0.39
MAPK1 P28482 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
TSHR P16473 2/20 0.39
PDE4A P27815 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39

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
SCHEMBL8997920 0.84 LMNA (0.42) LMNAARHTTHSD17B10ALDH1A1
SCHEMBL3953577 0.72 AR (0.47) LMNAARHTTHSD17B10ALDH1A1
SCHEMBL8667266 0.72 KDM4E (0.51) LMNAHTTHSD17B10ALDH1A1KDM4E
SCHEMBL28431276 0.69 HTT (0.46) LMNAARHTTHSD17B10ALDH1A1
SCHEMBL15362290 0.68 HTR7 (0.62) LMNAARHTTHSD17B10ALDH1A1
SCHEMBL8664432 0.67 LMNA (0.47) LMNAARHTTHSD17B10ALDH1A1
SCHEMBL3996329 0.67 CNR2 (0.42) LMNAARHTTHSD17B10ALDH1A1
SCHEMBL11567511 0.66 KDM4E (0.44) LMNAHTTHSD17B10ALDH1A1KDM4E
SCHEMBL891578 0.65 LMNA (0.36) LMNAHTTHSD17B10ALDH1A1HPGD
SCHEMBL5133066 0.65 LMNA (0.72) LMNAARHTTHSD17B10ALDH1A1

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