SCHEMBL9337367

SCHEMBL9337367

CCCCC(Oc1ccc(C(=O)c2cn(CCCC(=O)OCC)c3ccccc23)cc1)c1ccc(CC(C)C)cc1

nearest known ligand 0.66

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SRD5A1 P18405 5/20 0.66
SRD5A2 P31213 5/20 0.66
CNR1 P21554 6/20 0.51
POLB P06746 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
CNR2 P34972 7/20 0.47
CREBBP Q92793 1/20 0.44
ALDH1A1 P00352 2/20 0.41
TSHR P16473 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
LMNA P02545 1/20 0.41

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
SCHEMBL9337492 0.98 SRD5A1 (0.65) SRD5A1SRD5A2CNR1POLBL3MBTL1
SCHEMBL9337600 0.97 SRD5A1 (0.65) SRD5A1SRD5A2CNR1POLBL3MBTL1
SCHEMBL9334109 0.97 SRD5A1 (0.65) SRD5A1SRD5A2CNR1POLBL3MBTL1
SCHEMBL9335702 0.96 SRD5A1 (0.67) SRD5A1SRD5A2CNR1POLBL3MBTL1
SCHEMBL9441145 0.95 SRD5A1 (0.67) SRD5A1SRD5A2CNR1POLBL3MBTL1
SCHEMBL8793566 0.93 SRD5A1 (0.69) SRD5A1SRD5A2CNR1POLBL3MBTL1
SCHEMBL9545091 0.93 SRD5A1 (0.65) SRD5A1SRD5A2CNR1POLBL3MBTL1
SCHEMBL9543375 0.93 SRD5A1 (0.65) SRD5A1SRD5A2CNR1POLBL3MBTL1
SCHEMBL9394483 0.92 SRD5A1 (0.64) SRD5A1SRD5A2CNR1POLBL3MBTL1
SCHEMBL9334036 0.92 SRD5A1 (0.79) SRD5A1SRD5A2CNR1CNR2

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-5312829-A Testosterone 5alpha-reductase inhibitors FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-05-17 US disclosed
US-5212320-A Enzyme inhibitors FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-05-18 US disclosed