SCHEMBL6569460

SCHEMBL6569460

CN1CCN(c2cccc3c2CC(OC(=O)Nc2ccc(N4CCOCC4)cc2)C3)CC1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 3/20 0.49
▸ NPSR1 Q6W5P4 1/20 0.49
▸ L3MBTL1 Q9Y468 1/20 0.48
▸ NPC1 O15118 4/20 0.47
▸ RAB9A P51151 4/20 0.47
▸ ALDH1A1 P00352 3/20 0.47
▸ RAD52 P43351 1/20 0.46
▸ HTR1B P28222 5/20 0.46
▸ KCNH2 Q12809 1/20 0.46
▸ MAPT P10636 4/20 0.45
▸ SMN1; SMN2 Q16637 2/20 0.45

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
SCHEMBL4806699 0.83 ALDH1A1 (0.54) L3MBTL1NPC1RAB9AALDH1A1RAD52
SCHEMBL7063741 0.80 HTR1B (0.52) GAANPSR1NPC1RAB9AALDH1A1
SCHEMBL7063234 0.80 HTR1B (0.52) GAANPSR1NPC1RAB9AALDH1A1
SCHEMBL7062951 0.80 HTR1B (0.52) GAANPSR1NPC1RAB9AALDH1A1
SCHEMBL6913785 0.79 HTR1B (0.47) GAANPSR1NPC1RAB9AALDH1A1
SCHEMBL14596904 0.75 RAB9A (0.58) L3MBTL1NPC1RAB9AALDH1A1RAD52
SCHEMBL14370170 0.72 HTR1B (0.73) GAAL3MBTL1NPC1RAB9AALDH1A1
SCHEMBL5354642 0.72 HTR1B (0.73) GAAL3MBTL1NPC1RAB9AALDH1A1
SCHEMBL14263999 0.72 HTR1B (0.73) GAAL3MBTL1NPC1RAB9AALDH1A1
SCHEMBL7803574 0.71 HTR1B (0.55) GAANPSR1L3MBTL1NPC1RAB9A

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
EP-1025094-B1 SUBSTITUTED INDAN DERIVATIVES ASTRAZENECA AB (SE) 2004-08-25 — — EP claimed
Send feedback