SCHEMBL9066592

SCHEMBL9066592

C=C[C@H]1CC[C@H]2[C@@H]3CCC4CC(C(=O)O)CC[C@]4(C)[C@H]3CC[C@]12C

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRD5A2 P31213 1/20 0.61
CYP3A4 P08684 3/20 0.46
LMNA P02545 3/20 0.46
GABRP O00591 2/20 0.46
GABRD O14764 2/20 0.46
G6PD P11413 2/20 0.46
GABRA1 P14867 2/20 0.46
GABRB1 P18505 2/20 0.46
GABRG2 P18507 2/20 0.46
GABRB3 P28472 2/20 0.46
GABRA5 P31644 2/20 0.46
GABRA3 P34903 2/20 0.46
GABRA2 P47869 2/20 0.46
GABRB2 P47870 2/20 0.46
GABRA4 P48169 2/20 0.46
GABRE P78334 2/20 0.46
GABRA6 Q16445 2/20 0.46
GABRG1 Q8N1C3 2/20 0.46
GABRG3 Q99928 2/20 0.46
GABRQ Q9UN88 2/20 0.46

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
SCHEMBL3655314 0.82 VDR (0.48) CYP3A4LMNAGABRPGABRDG6PD
SCHEMBL3655313 0.82 VDR (0.48) CYP3A4LMNAGABRPGABRDG6PD
SCHEMBL3653135 0.82 VDR (0.48) CYP3A4LMNAGABRPGABRDG6PD
SCHEMBL3653133 0.82 VDR (0.48) CYP3A4LMNAGABRPGABRDG6PD
SCHEMBL3655510 0.82 LMNA (0.68) CYP3A4LMNAGABRPGABRDG6PD
SCHEMBL3654366 0.82 LMNA (0.68) CYP3A4LMNAGABRPGABRDG6PD
SCHEMBL13917761 0.82 LMNA (0.68) CYP3A4LMNAGABRPGABRDG6PD
SCHEMBL3651742 0.82 LMNA (0.68) CYP3A4LMNAGABRPGABRDG6PD
SCHEMBL3651739 0.82 LMNA (0.68) CYP3A4LMNAGABRPGABRDG6PD
SCHEMBL3652170 0.82 LMNA (0.68) CYP3A4LMNAGABRPGABRDG6PD

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5494914-A USEFUL FOR TREATMENT OF DISEASES WHOSE PROGRESS IS AIDED BY ACTIVATION OF ANDROGEN RECEPTORS ENDORECHERCHE (CA) 1996-02-27 US disclosed
EP-0641211-A1 INHIBITORS OF TESTOSTERONE 5$g(a)-REDUCTASE ACTIVITY ENDORECHERCHE INC. (CA) 1995-03-08 EP disclosed
WO-1993023053-A1 INHIBITORS OF TESTOSTERONE 5α-REDUCTASE ACTIVITY ENDORECHERCHE INC. (CA) 1993-11-25 WO disclosed