SCHEMBL6337359

SCHEMBL6337359

CC(C)(C)OC(=O)N1CCC[C@@H]1CCCO

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.45
ATM Q13315 2/20 0.45
SMN1; SMN2 Q16637 1/20 0.43
ALDH1A1 P00352 2/20 0.42
L3MBTL1 Q9Y468 2/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
PDE8B O95263 1/20 0.40
OPRD1 P41143 1/20 0.40
NPC1 O15118 1/20 0.40
POLB P06746 1/20 0.40
CHEK2 O96017 1/20 0.39
TSHR P16473 1/20 0.39
FPR3 P25089 1/20 0.39
FPR2 P25090 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
SCHEMBL6337357 1.00 HSD17B10 (0.45) HSD17B10ATMSMN1; SMN2ALDH1A1L3MBTL1
SCHEMBL6337962 1.00 HSD17B10 (0.45) HSD17B10ATMSMN1; SMN2ALDH1A1L3MBTL1
SCHEMBL3422188 0.96 ATM (0.47) HSD17B10ATMSMN1; SMN2ALDH1A1L3MBTL1
SCHEMBL29551106 0.96 ATM (0.47) HSD17B10ATMSMN1; SMN2ALDH1A1L3MBTL1
SCHEMBL29550329 0.96 ATM (0.47) HSD17B10ATMSMN1; SMN2ALDH1A1L3MBTL1
SCHEMBL6338610 0.94 ATM (0.43) HSD17B10ATMSMN1; SMN2ALDH1A1L3MBTL1
SCHEMBL29551092 0.92 ATM (0.46) HSD17B10ATMSMN1; SMN2ALDH1A1L3MBTL1
SCHEMBL29550594 0.92 ATM (0.46) HSD17B10ATMSMN1; SMN2ALDH1A1L3MBTL1
SCHEMBL639097 0.91 ATM (0.49) HSD17B10ATMSMN1; SMN2ALDH1A1L3MBTL1
SCHEMBL3420227 0.91 ATM (0.49) HSD17B10ATMSMN1; SMN2ALDH1A1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015028409-A1 6,7-DIHYDRO-5H-BENZO[7]ANNULENE DERIVATIVES, METHOD FOR THE PREPARATION THEREOF, PHARMACEUTICAL PREPARATIONS COMPRISING THEM, AND THE USE THEREOF FOR PRODUCING MEDICAMENTS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2015-03-05 WO disclosed
WO-2015028409-A1 6,7-DIHYDRO-5H-BENZO[7]ANNULENE DERIVATIVES, METHOD FOR THE PREPARATION THEREOF, PHARMACEUTICAL PREPARATIONS COMPRISING THEM, AND THE USE THEREOF FOR PRODUCING MEDICAMENTS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2015-03-05 WO disclosed
US-6878736-B1 Histamine H3 receptor ligands JAMES BLACK FOUNDATION LIMITED (GB) 2005-04-12 US disclosed
EP-1056733-A1 HISTAMINE H3 RECEPTOR LIGANDS JAMES BLACK FOUNDATION LIMITED (GB) 2000-12-06 EP disclosed
WO-1999042458-A1 HISTAMINE H3 RECEPTOR LIGANDS JAMES BLACK FOUNDATION LIMITED (GB) 1999-08-26 WO disclosed