SCHEMBL8169377

SCHEMBL8169377

COc1ccc2c(c1)CC[C@H]1[C@H]2CCCN1C

nearest known ligand 0.63

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SRD5A1 P18405 2/20 0.63
SIGMAR1 Q99720 1/20 0.52
HSD11B1 P28845 4/20 0.52

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
SCHEMBL8169380 1.00 SRD5A1 (0.63) SRD5A1SIGMAR1HSD11B1
SCHEMBL1884010 0.78 HSD11B1 (0.80) SRD5A1SIGMAR1HSD11B1
SCHEMBL1884009 0.78 HSD11B1 (0.80) SRD5A1SIGMAR1HSD11B1
SCHEMBL15139435 0.78 HSD11B1 (0.80) SRD5A1SIGMAR1HSD11B1
SCHEMBL9964011 0.78 HSD11B1 (0.80) SRD5A1SIGMAR1HSD11B1
SCHEMBL7797807 0.77 SRD5A1 (1.00) SRD5A1
SCHEMBL7797809 0.77 SRD5A1 (1.00) SRD5A1
SCHEMBL8168469 0.77 HTR1A (0.58) SRD5A1SIGMAR1HSD11B1
SCHEMBL8172160 0.77 HTR1A (0.58) SRD5A1SIGMAR1HSD11B1
SCHEMBL8172163 0.77 HTR1A (0.58) SRD5A1SIGMAR1HSD11B1

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
US-6080752-A FOR TREATING CONDITION WHICH REQUIRES ANTAGONISM OF A DOPAMINE RECEPTOR SUCH AS PSYCHTIC CONDITION SMITHKLINE BEECHAM PLC (GB) 2000-06-27 US disclosed