SCHEMBL10577670

SCHEMBL10577670

CC(=O)OC1CCC2C3CCC(=O)C(C)C3CCC12C

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 2/20 0.52
▸ MEN1 O00255 1/20 0.52
▸ LMNA P02545 1/20 0.52
▸ ALOX15 P16050 1/20 0.52
▸ MAPK1 P28482 1/20 0.52
▸ BRCA1 P38398 1/20 0.52
▸ RECQL P46063 1/20 0.52
▸ KMT2A Q03164 1/20 0.52
▸ CYP19A1 P11511 4/20 0.49
▸ ESR1 P03372 2/20 0.49
▸ TP53 P04637 1/20 0.49
▸ MAPT P10636 1/20 0.49
▸ SMN1; SMN2 Q16637 1/20 0.49
▸ CYP2C19 P33261 1/20 0.46
▸ CYP17A1 P05093 1/20 0.44

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
SCHEMBL20281140 0.80 SERPINA6 (0.59) CYP3A4MEN1LMNAMAPK1KMT2A
SCHEMBL16742396 0.78 SHBG (0.67) CYP3A4MEN1LMNAALOX15MAPK1
SCHEMBL16739258 0.78 SHBG (0.67) CYP3A4MEN1LMNAALOX15MAPK1
SCHEMBL6818142 0.78 SHBG (0.67) CYP3A4MEN1LMNAALOX15MAPK1
SCHEMBL10577802 0.78 SHBG (0.59) CYP3A4LMNAMAPK1CYP19A1ESR1
SCHEMBL20408880 0.78 SHBG (0.59) CYP3A4LMNAMAPK1CYP19A1ESR1
SCHEMBL2930366 0.76 MAPT (0.71) CYP3A4MEN1LMNAALOX15MAPK1
SCHEMBL17302789 0.76 MAPT (0.71) CYP3A4MEN1LMNAALOX15MAPK1
SCHEMBL13415930 0.76 CYP17A1 (0.52) CYP3A4MEN1LMNAALOX15MAPK1
SCHEMBL28600625 0.76 SHBG (0.44) CYP3A4MEN1LMNAALOX15MAPK1

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-4874898-A ANTIANDROGENS SHIONOGI AND CO., LTD. PATENT DEPARTMENT (JP) 1989-10-17 — — US disclosed
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