SCHEMBL11798362

SCHEMBL11798362

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

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR3C1 P04150 8/20 0.62
▸ PGR P06401 8/20 0.62
▸ USP2 O75604 7/20 0.62
▸ HIF1A Q16665 6/20 0.62
▸ CYP3A4 P08684 6/20 0.62
▸ LMNA P02545 6/20 0.62
▸ CNR1 P21554 4/20 0.62
▸ CYP2C9 P11712 3/20 0.62
▸ KDM4E B2RXH2 1/20 0.62
▸ ALDH1A1 P00352 1/20 0.62
▸ TDP1 Q9NUW8 1/20 0.62
▸ ADORA3 P0DMS8 3/20 0.57
▸ AR P10275 1/20 0.57
▸ CHRM1 P11229 1/20 0.57
▸ TBXA2R P21731 1/20 0.57
▸ NR1I2 O75469 4/20 0.55
▸ MAPT P10636 2/20 0.55
▸ DRD2 P14416 1/20 0.55
▸ OPRD1 P41143 1/20 0.55
▸ CYP2D6 P10635 2/20 0.53

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
SCHEMBL11798350 1.00 NR3C1 (0.62) NR3C1PGRUSP2HIF1ACYP3A4
SCHEMBL11788733 0.94 NR3C1 (0.70) NR3C1PGRUSP2HIF1ACYP3A4
SCHEMBL11788721 0.94 NR3C1 (0.70) NR3C1PGRUSP2HIF1ACYP3A4
SCHEMBL11794144 0.92 NR3C1 (0.64) NR3C1PGRUSP2HIF1ACYP3A4
SCHEMBL11794137 0.92 NR3C1 (0.64) NR3C1PGRUSP2HIF1ACYP3A4
SCHEMBL11795449 0.92 PGR (0.54) NR3C1PGRUSP2HIF1ACYP3A4
SCHEMBL11795442 0.92 PGR (0.54) NR3C1PGRUSP2HIF1ACYP3A4
SCHEMBL11791454 0.90 NR3C1 (0.58) NR3C1PGRUSP2HIF1ACYP3A4
SCHEMBL11791396 0.90 NR3C1 (0.58) NR3C1PGRUSP2HIF1ACYP3A4
SCHEMBL11792650 0.89 USP2 (0.65) NR3C1PGRUSP2HIF1ACYP3A4

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
US-3933799-A HORMONES GLAXO LABORATORIES LIMITED (EN) 1976-01-20 — — US disclosed
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