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Sugi Predict / Compounds / SCHEMBL11237658

SCHEMBL11237658

SCHEMBL11237658

CC(C)(C)[SiH2]OC(C)(C)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C=C(O[Si](C)(C)C)CC[C@]4(C)[C@H]3CC[C@]12C

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ SRD5A2 P31213 3/20 0.35
▸ SRD5A1 P18405 1/20 0.33
▸ CYP19A1 P11511 1/20 0.31

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
SCHEMBL11237662 1.00 SRD5A2 (0.35) SRD5A2SRD5A1CYP19A1
SCHEMBL11246663 0.74 SRD5A2 (0.47) SRD5A2SRD5A1
SCHEMBL11246664 0.72 SRD5A2 (0.48) SRD5A2SRD5A1
SCHEMBL11250029 0.67 LMNA (0.61) CYP19A1
SCHEMBL11253127 0.67 SRD5A1 (0.39) SRD5A2SRD5A1
SCHEMBL11253131 0.67 SRD5A1 (0.39) SRD5A2SRD5A1
SCHEMBL16846107 0.65 SRD5A2 (0.51) SRD5A2SRD5A1
SCHEMBL16846120 0.63 CYP19A1 (0.54) CYP19A1
SCHEMBL9822591 0.61 SRD5A2 (0.53) SRD5A2SRD5A1
SCHEMBL16846119 0.61 GRIN1 (0.41) SRD5A2SRD5A1CYP19A1

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-4317817-A SKIN DISORDERS; ACEME; ENZYME INHIBITORS RICHARDSON-MERRELL INC. (US) 1982-03-02 — — US disclosed