SCHEMBL7878115

SCHEMBL7878115

CC(=O)O[C@]1(C(C)=O)CC[C@H]2[C@@H]3CC(C)(C)C4=CC(=O)[C@@H]5CC5[C@@H]4[C@H]3CC[C@@]21C

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PGR P06401 8/20 0.54
▸ CYP3A4 P08684 7/20 0.54
▸ AR P10275 7/20 0.54
▸ NR3C1 P04150 7/20 0.54
▸ LMNA P02545 6/20 0.54
▸ SMN1; SMN2 Q16637 5/20 0.54
▸ NPSR1 Q6W5P4 4/20 0.54
▸ ALDH1A1 P00352 3/20 0.54
▸ CHRM2 P08172 3/20 0.54
▸ ABCB11 O95342 2/20 0.54
▸ CHRM1 P11229 2/20 0.54
▸ USP2 O75604 2/20 0.54
▸ ESR1 P03372 2/20 0.54
▸ ABCC4 O15439 1/20 0.54
▸ SHBG P04278 1/20 0.54
▸ NR3C2 P08235 1/20 0.54
▸ HRH2 P25021 1/20 0.54
▸ AKR1C3 P42330 1/20 0.54
▸ AKR1C2 P52895 1/20 0.54
▸ AKR1C1 Q04828 1/20 0.54

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
SCHEMBL8722471 0.82 NR3C1 (0.59) PGRCYP3A4ARNR3C1LMNA
SCHEMBL7887204 0.82 NR3C1 (0.59) PGRCYP3A4ARNR3C1LMNA
SCHEMBL7885034 0.82 NR3C1 (0.59) PGRCYP3A4ARNR3C1LMNA
SCHEMBL7882961 0.82 NR3C1 (0.59) PGRCYP3A4ARNR3C1LMNA
SCHEMBL7887205 0.82 PGR (0.61) PGRCYP3A4ARNR3C1LMNA
SCHEMBL10704998 0.75 NR3C1 (0.65) PGRCYP3A4ARNR3C1LMNA
SCHEMBL11806728 0.74 CYP3A4 (0.58) PGRCYP3A4ARNR3C1LMNA
SCHEMBL11798628 0.74 CYP3A4 (0.61) PGRCYP3A4ARNR3C1LMNA
SCHEMBL11798411 0.74 CYP3A4 (0.58) PGRCYP3A4ARNR3C1LMNA
SCHEMBL11798314 0.74 CYP3A4 (0.58) PGRCYP3A4ARNR3C1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6180803-B1 STEROID DRUGS LABORATOIRE THERAMEX (MC) 2001-01-30 — — US claimed
US-6180803-B1 STEROID DRUGS LABORATOIRE THERAMEX (MC) 2001-01-30 — — US disclosed
EP-0886645-B1 NEW 19-NOR-PREGNENE DERIVATIVES THERAMEX (MC) 1999-09-01 — — EP disclosed
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