SCHEMBL10601034

SCHEMBL10601034

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

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PGR P06401 5/20 0.50
▸ AR P10275 4/20 0.50
▸ ESR1 P03372 2/20 0.49
▸ SLC6A4 P31645 2/20 0.49
▸ CYP2C19 P33261 2/20 0.49
▸ CHRM2 P08172 1/20 0.49
▸ ACHE P22303 1/20 0.49
▸ SLC6A2 P23975 1/20 0.49
▸ LMNA P02545 2/20 0.47
▸ CYP3A4 P08684 2/20 0.47
▸ ABCB11 O95342 2/20 0.47
▸ TSHR P16473 1/20 0.47
▸ HIF1A Q16665 1/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ NR3C1 P04150 1/20 0.47
▸ SHBG P04278 1/20 0.47
▸ ADRA2A P08913 1/20 0.47
▸ NR3C2 P08235 1/20 0.45
▸ STS P08842 1/20 0.44
▸ CYP19A1 P11511 2/20 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
SCHEMBL11857435 0.87 PGR (0.55) PGRARESR1SLC6A4CYP2C19
SCHEMBL11857444 0.87 PGR (0.55) PGRARESR1SLC6A4CYP2C19
SCHEMBL11861768 0.87 PGR (0.55) PGRARESR1SLC6A4CYP2C19
SCHEMBL11861765 0.87 PGR (0.55) PGRARESR1SLC6A4CYP2C19
SCHEMBL6008256 0.86 PGR (0.51) PGRARESR1SLC6A4CYP2C19
SCHEMBL11788940 0.84 LMNA (0.69) PGRARESR1SLC6A4CYP2C19
SCHEMBL10603383 0.84 LMNA (0.69) PGRARESR1SLC6A4CYP2C19
SCHEMBL9472235 0.83 LMNA (0.62) PGRARESR1SLC6A4CYP2C19
SCHEMBL7882963 0.83 LMNA (0.62) PGRARESR1SLC6A4CYP2C19
Norethandrolone SCHEMBL23801611 0.81 LMNA (0.71) PGRARESR1SLC6A4CYP2C19

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
EP-0159739-B1 STEROIDS FOR USE AS IMMUNOMODULATORS AKZO N.V. (NL) 1989-05-10 — — EP disclosed
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