SCHEMBL9191538

SCHEMBL9191538

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

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SERPINA6 P08185 4/20 0.61
▸ LMNA P02545 4/20 0.61
▸ HSD17B10 Q99714 3/20 0.61
▸ NR3C1 P04150 3/20 0.61
▸ SMN1; SMN2 Q16637 3/20 0.61
▸ TSHR P16473 2/20 0.61
▸ SHBG P04278 2/20 0.61
▸ CYP2D6 P10635 1/20 0.61
▸ ALDH1A1 P00352 1/20 0.61
▸ CYP3A4 P08684 1/20 0.61
▸ PMP22 Q01453 1/20 0.61
▸ KCNA1 Q09470 1/20 0.61
▸ SLC47A1 Q96FL8 1/20 0.61
▸ FNTA P49354 6/20 0.58
▸ FNTB P49356 6/20 0.58
▸ MEN1 O00255 2/20 0.58
▸ KMT2A Q03164 2/20 0.58
▸ BLM P54132 2/20 0.58
▸ AR P10275 1/20 0.58
▸ POLB P06746 1/20 0.57

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
SCHEMBL10381224 1.00 SERPINA6 (0.61) SERPINA6LMNAHSD17B10NR3C1SMN1; SMN2
SCHEMBL9267304 0.89 HSD17B10 (0.63) SERPINA6LMNAHSD17B10NR3C1SMN1; SMN2
SCHEMBL11845368 0.89 HSD17B10 (0.71) SERPINA6LMNAHSD17B10NR3C1SMN1; SMN2
SCHEMBL9267319 0.89 HSD17B10 (0.63) SERPINA6LMNAHSD17B10NR3C1SMN1; SMN2
SCHEMBL11845386 0.89 HSD17B10 (0.71) SERPINA6LMNAHSD17B10NR3C1SMN1; SMN2
SCHEMBL11852315 0.89 HSD17B10 (0.71) SERPINA6LMNAHSD17B10NR3C1SMN1; SMN2
SCHEMBL9193185 0.87 FNTA (0.73) SERPINA6LMNAHSD17B10NR3C1SMN1; SMN2
SCHEMBL9193196 0.87 FNTA (0.73) SERPINA6LMNAHSD17B10NR3C1SMN1; SMN2
SCHEMBL10868078 0.84 SERPINA6 (0.80) SERPINA6LMNAHSD17B10NR3C1SMN1; SMN2
SCHEMBL9221947 0.84 SERPINA6 (0.80) SERPINA6LMNAHSD17B10NR3C1SMN1; SMN2

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-0431151-B1 METHOD FOR PREPARING 21-BROM-4-PREGNEN-3,20-DIONE DERIVATIVES SCHERING AG (DE) 1995-03-15 — — EP 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
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