SCHEMBL8533129

SCHEMBL8533129

Cc1cc2c(cc1C)C(O)C(CCN1CCCC1)CC2

nearest known ligand 0.45

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 5/20 0.45
HTR2A P28223 5/20 0.45
TP53 P04637 1/20 0.35
HRH3 Q9Y5N1 1/20 0.35
SIGMAR1 Q99720 1/20 0.34

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
SCHEMBL8534940 0.83 DRD2 (0.38) DRD2HTR2A
SCHEMBL8533128 0.78 DRD2 (0.49) DRD2HTR2AHRH3SIGMAR1
SCHEMBL8532322 0.78 DRD2 (0.38) DRD2HTR2AHRH3
SCHEMBL8533143 0.72 DRD2 (0.40) DRD2HTR2ASIGMAR1
SCHEMBL8199358 0.70 BACE1 (0.57) HRH3
SCHEMBL8199355 0.70 BACE1 (0.57) HRH3
SCHEMBL8199357 0.70 BACE1 (0.57) HRH3
SCHEMBL8535562 0.69 DRD2 (0.38) DRD2HTR2A
SCHEMBL8236868 0.66 SLC6A9 (0.51) DRD2HTR2A
SCHEMBL8198558 0.65 SLC18A3 (0.46) DRD2HTR2ATP53SIGMAR1

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-5847159-A 1- ω-(3,4-dihydro-2-naphthalenyl)alkyl!-cyclic amine derivatives, process for preparing the same, and pharmaceutical composition containing the same DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 1998-12-08 US disclosed
EP-0825180-A1 1-OMEGA-(3,4-DIHYDRO-2-NAPHTHALENYL)ALKYL] CYCLIC AMINE DERIVATIVES, PROCESS FOR PRODUCING THE SAME, AND MEDICINAL COMPOSITION CONTAINING THE SAME DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 1998-02-25 EP disclosed