Sugi Predict

Sugi Predict / Compounds / SCHEMBL9286706

SCHEMBL9286706

SCHEMBL9286706

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

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ SRD5A1 P18405 17/20 1.00
▸ SRD5A2 P31213 3/20 0.71
▸ HSD17B7 P56937 2/20 0.67

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
SCHEMBL9067243 0.84 SRD5A1 (1.00) SRD5A1SRD5A2HSD17B7
SCHEMBL9270109 0.84 SRD5A1 (1.00) SRD5A1SRD5A2HSD17B7
SCHEMBL9066669 0.83 SRD5A1 (1.00) SRD5A1SRD5A2HSD17B7
SCHEMBL9066601 0.83 SRD5A1 (1.00) SRD5A1SRD5A2HSD17B7
SCHEMBL9065996 0.82 SRD5A1 (1.00) SRD5A1SRD5A2HSD17B7
SCHEMBL9065998 0.82 SRD5A1 (1.00) SRD5A1SRD5A2HSD17B7
SCHEMBL9065971 0.81 SRD5A1 (1.00) SRD5A1SRD5A2HSD17B7
SCHEMBL9286015 0.81 SRD5A1 (1.00) SRD5A1SRD5A2HSD17B7
SCHEMBL9066263 0.81 SRD5A1 (1.00) SRD5A1SRD5A2HSD17B7
SCHEMBL9066257 0.80 SRD5A1 (1.00) SRD5A1SRD5A2HSD17B7

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
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