SCHEMBL8959983

SCHEMBL8959983

CCCCC(OCCCCCc1cn(CCCC(=O)O)c2ccccc12)c1ccc(CC(C)C)cc1

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SRD5A1 P18405 5/20 0.53
SRD5A2 P31213 5/20 0.53
CDC25A P30304 1/20 0.46
OXER1 Q8TDS5 2/20 0.45
MCL1 Q07820 2/20 0.43
ADRA1D P25100 5/20 0.43
ADRA1B P35368 1/20 0.43
ADRA1A P35348 2/20 0.41
ICMT O60725 1/20 0.41
TERT O14746 2/20 0.40

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
SCHEMBL8959660 0.91 SRD5A1 (0.43) SRD5A1SRD5A2CDC25AOXER1MCL1
SCHEMBL8959973 0.87 SRD5A1 (0.59) SRD5A1SRD5A2
SCHEMBL8959858 0.87 SRD5A1 (0.58) SRD5A1SRD5A2
SCHEMBL9288243 0.84 OXER1 (0.38) SRD5A1SRD5A2OXER1MCL1
SCHEMBL8959958 0.83 SRD5A1 (0.55) SRD5A1SRD5A2CDC25AOXER1MCL1
SCHEMBL8959688 0.79 SRD5A1 (0.55) SRD5A1SRD5A2
SCHEMBL8959679 0.79 SRD5A1 (0.55) SRD5A1SRD5A2
SCHEMBL8959655 0.79 SRD5A1 (0.49) SRD5A1SRD5A2
SCHEMBL8959830 0.78 CNR1 (0.49) SRD5A1SRD5A2
SCHEMBL9334036 0.78 SRD5A1 (0.79) SRD5A1SRD5A2ADRA1DADRA1BADRA1A

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