SCHEMBL9193196

SCHEMBL9193196

CC(=O)OCC(=O)[C@@]1(O)C(C)C[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3C(=O)C[C@@]21C

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FNTA P49354 7/20 0.73
▸ FNTB P49356 7/20 0.73
▸ AR P10275 3/20 0.73
▸ KMT2A Q03164 3/20 0.73
▸ NR3C1 P04150 2/20 0.73
▸ TSHR P16473 2/20 0.73
▸ MEN1 O00255 2/20 0.73
▸ BLM P54132 1/20 0.73
▸ LMNA P02545 4/20 0.58
▸ HSD17B10 Q99714 3/20 0.58
▸ SERPINA6 P08185 3/20 0.58
▸ SMN1; SMN2 Q16637 3/20 0.58
▸ ALDH1A1 P00352 3/20 0.58
▸ CYP3A4 P08684 2/20 0.58
▸ CYP2D6 P10635 1/20 0.58
▸ SHBG P04278 1/20 0.58
▸ PMP22 Q01453 1/20 0.58
▸ KCNA1 Q09470 1/20 0.58
▸ SLC47A1 Q96FL8 1/20 0.58
▸ PGR P06401 2/20 0.53

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
SCHEMBL9193185 1.00 FNTA (0.73) FNTAFNTBARKMT2ANR3C1
SCHEMBL11852315 0.88 HSD17B10 (0.71) FNTAFNTBARKMT2ANR3C1
SCHEMBL11845368 0.88 HSD17B10 (0.71) FNTAFNTBARKMT2ANR3C1
SCHEMBL11845386 0.88 HSD17B10 (0.71) FNTAFNTBARKMT2ANR3C1
SCHEMBL9267319 0.88 HSD17B10 (0.63) FNTAFNTBARKMT2ANR3C1
SCHEMBL9267304 0.88 HSD17B10 (0.63) FNTAFNTBARKMT2ANR3C1
SCHEMBL10381224 0.87 SERPINA6 (0.61) FNTAFNTBARKMT2ANR3C1
SCHEMBL9191538 0.87 SERPINA6 (0.61) FNTAFNTBARKMT2ANR3C1
SCHEMBL11413691 0.86 SERPINA6 (0.64) FNTAFNTBARKMT2ANR3C1
SCHEMBL11109164 0.86 SERPINA6 (0.64) FNTAFNTBARKMT2ANR3C1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0431151-B1 METHOD FOR PREPARING 21-BROM-4-PREGNEN-3,20-DIONE DERIVATIVES SCHERING AG (DE) 1995-03-15 — — EP disclosed
US-5332847-A Process for the preparation of 21-bromo-4-pregnene-3,20-dione derivatives SCHERING AKTIENGESELLSCHAFT (DE) 1994-07-26 — — US disclosed
WO-1990013558-A1 METHOD FOR PREPARING 21-BROM-4-PREGNEN-3,20-DIONE DERIVATIVES SCHERING AKTIENGESELLSCHAFT BERLIN UND BERGKAMEN (DE) 1990-11-15 — — WO disclosed
US-3947409-A 16-Alkyl-1,4,9(11)-pregnatrienes and 9,11-epoxides thereof MERCK & CO., INC. (US) 1976-03-30 — — US disclosed
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