SCHEMBL11311760

SCHEMBL11311760

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

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR3C1 P04150 12/20 0.67
▸ MMP1 P03956 6/20 0.67
▸ CYP3A4 P08684 5/20 0.66
▸ PGR P06401 4/20 0.66
▸ USP2 O75604 3/20 0.66
▸ LMNA P02545 3/20 0.66
▸ NR1I2 O75469 2/20 0.66
▸ MAPT P10636 2/20 0.66
▸ SMN1; SMN2 Q16637 2/20 0.66
▸ CYP2C9 P11712 2/20 0.66
▸ MLNR O43193 1/20 0.66
▸ ABCB11 O95342 1/20 0.66
▸ CYP3A5 P20815 1/20 0.66
▸ PPARG P37231 1/20 0.66
▸ NPSR1 Q6W5P4 1/20 0.66
▸ CYP2D6 P10635 1/20 0.66
▸ ADORA3 P0DMS8 1/20 0.65
▸ DRD2 P14416 1/20 0.65
▸ OPRD1 P41143 1/20 0.65
▸ MEN1 O00255 1/20 0.64

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
SCHEMBL11229362 0.92 NR3C1 (0.79) NR3C1MMP1CYP3A4PGRUSP2
SCHEMBL11228768 0.91 NR3C1 (0.69) NR3C1MMP1CYP3A4PGRUSP2
SCHEMBL11246943 0.91 NR3C1 (0.69) NR3C1MMP1CYP3A4PGRUSP2
SCHEMBL11308113 0.90 NR3C1 (0.74) NR3C1MMP1CYP3A4PGRUSP2
SCHEMBL8859709 0.90 NR3C1 (0.74) NR3C1MMP1CYP3A4PGRUSP2
SCHEMBL11583661 0.89 NR3C1 (0.75) NR3C1MMP1CYP3A4PGRUSP2
SCHEMBL11583662 0.89 NR3C1 (0.75) NR3C1MMP1CYP3A4PGRUSP2
SCHEMBL11228765 0.89 NR3C1 (0.69) NR3C1MMP1CYP3A4PGRUSP2
SCHEMBL11321138 0.88 NR3C1 (0.78) NR3C1MMP1CYP3A4PGRUSP2
SCHEMBL11690649 0.88 NR3C1 (0.69) NR3C1MMP1CYP3A4PGRUSP2

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
US-4263289-A ANTIINFLAMMATORY STEROIDS SYNTEX (U.S.A.) INC. (US) 1981-04-21 — — US claimed
US-4263289-A ANTIINFLAMMATORY STEROIDS SYNTEX (U.S.A.) INC. (US) 1981-04-21 — — US disclosed
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