SCHEMBL8959830

SCHEMBL8959830

CCCCC(OCCC(=O)c1cn(CCCC(=O)OCC)c2ccccc12)c1ccc(CC(C)C)cc1

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 4/20 0.49
CREBBP Q92793 1/20 0.48
SRD5A1 P18405 5/20 0.48
SRD5A2 P31213 5/20 0.48
CNR2 P34972 10/20 0.46
LMNA P02545 1/20 0.42

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
SCHEMBL8959655 0.95 SRD5A1 (0.49) CNR1CREBBPSRD5A1SRD5A2CNR2
SCHEMBL8959858 0.91 SRD5A1 (0.58) CNR1CREBBPSRD5A1SRD5A2CNR2
SCHEMBL8959660 0.88 SRD5A1 (0.43) CNR1CREBBPSRD5A1SRD5A2
SCHEMBL8959720 0.87 CNR1 (0.51) CNR1CREBBPSRD5A1SRD5A2CNR2
SCHEMBL8959893 0.86 CNR1 (0.50) CNR1CREBBPSRD5A1SRD5A2CNR2
SCHEMBL8959973 0.86 SRD5A1 (0.59) CNR1SRD5A1SRD5A2CNR2
SCHEMBL9337367 0.84 SRD5A1 (0.66) CNR1CREBBPSRD5A1SRD5A2CNR2
SCHEMBL8959531 0.83 CNR1 (0.50) CNR1CREBBPSRD5A1SRD5A2CNR2
SCHEMBL8959704 0.82 CNR1 (0.56) CNR1CREBBPSRD5A1SRD5A2CNR2
SCHEMBL9337492 0.82 SRD5A1 (0.65) CNR1CREBBPSRD5A1SRD5A2CNR2

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-5530019-A FOR TREATMENT OF PROSTATE GLAND DISORDERS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-06-25 US disclosed