SCHEMBL7887183

SCHEMBL7887183

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

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AR P10275 8/20 0.58
▸ PGR P06401 8/20 0.58
▸ CYP3A4 P08684 7/20 0.58
▸ NR3C1 P04150 7/20 0.58
▸ LMNA P02545 4/20 0.58
▸ SMN1; SMN2 Q16637 4/20 0.58
▸ CHRM2 P08172 4/20 0.58
▸ ALDH1A1 P00352 3/20 0.58
▸ NPSR1 Q6W5P4 3/20 0.58
▸ ABCB11 O95342 3/20 0.58
▸ CHRM1 P11229 3/20 0.58
▸ USP2 O75604 2/20 0.58
▸ ESR1 P03372 2/20 0.58
▸ ABCC4 O15439 1/20 0.58
▸ SHBG P04278 1/20 0.58
▸ NR3C2 P08235 1/20 0.58
▸ HRH2 P25021 1/20 0.58
▸ AKR1C3 P42330 1/20 0.58
▸ AKR1C2 P52895 1/20 0.58
▸ AKR1C1 Q04828 1/20 0.58

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
SCHEMBL7887184 0.87 PGR (0.65) ARPGRCYP3A4NR3C1LMNA
SCHEMBL7885034 0.86 NR3C1 (0.59) ARPGRCYP3A4NR3C1LMNA
SCHEMBL7882961 0.86 NR3C1 (0.59) ARPGRCYP3A4NR3C1LMNA
SCHEMBL8722471 0.86 NR3C1 (0.59) ARPGRCYP3A4NR3C1LMNA
SCHEMBL7887204 0.86 NR3C1 (0.59) ARPGRCYP3A4NR3C1LMNA
SCHEMBL8722476 0.84 CYP3A4 (0.55) ARPGRCYP3A4NR3C1LMNA
SCHEMBL7882966 0.80 NR3C1 (0.61) ARPGRCYP3A4NR3C1LMNA
SCHEMBL7887175 0.80 NR3C1 (0.61) ARPGRCYP3A4NR3C1LMNA
SCHEMBL7886076 0.78 NR3C1 (0.56) ARPGRCYP3A4NR3C1LMNA
SCHEMBL8721585 0.78 PGR (0.54) ARPGRCYP3A4NR3C1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
EP-0886645-A1 NEW 19-NOR-PREGNENE DERIVATIVES LABORATOIRE THERAMEX (MC) 1998-12-30 — — EP disclosed
WO-1997027210-A1 NEW 19-NOR-PREGNENE DERIVATIVES LABORATOIRE THERAMEX (MC) 1997-07-31 — — WO disclosed
EP-0785212-A1 New 19-nor-pregnene derivatives LABORATOIRE THERAMEX (MC) 1997-07-23 — — EP disclosed
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