SCHEMBL10408663

SCHEMBL10408663

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

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PGR P06401 4/20 0.65
▸ AR P10275 1/20 0.65
▸ CHRM1 P11229 1/20 0.65
▸ NR3C2 P08235 5/20 0.60
▸ NR3C1 P04150 3/20 0.60
▸ HIF1A Q16665 8/20 0.57
▸ CYP3A4 P08684 4/20 0.57
▸ CYP2C9 P11712 3/20 0.57
▸ TSHR P16473 2/20 0.57
▸ HSD17B10 Q99714 1/20 0.57
▸ ALDH1A1 P00352 1/20 0.57
▸ KMT2A Q03164 2/20 0.56
▸ SMN1; SMN2 Q16637 3/20 0.52
▸ POLB P06746 1/20 0.52
▸ GAA P10253 1/20 0.52
▸ MAPT P10636 1/20 0.52
▸ LMNA P02545 2/20 0.51
▸ USP2 O75604 1/20 0.51
▸ CYP2D6 P10635 1/20 0.51
▸ PMP22 Q01453 1/20 0.49

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
SCHEMBL10408664 1.00 PGR (0.65) PGRARCHRM1NR3C2NR3C1
SCHEMBL10408760 0.97 PGR (0.63) PGRARCHRM1NR3C2NR3C1
SCHEMBL10408761 0.97 PGR (0.63) PGRARCHRM1NR3C2NR3C1
SCHEMBL10408757 0.97 NR3C2 (0.64) PGRARCHRM1NR3C2NR3C1
SCHEMBL10408758 0.97 NR3C2 (0.64) PGRARCHRM1NR3C2NR3C1
SCHEMBL10408659 0.95 PGR (0.69) PGRARCHRM1NR3C2NR3C1
SCHEMBL9814631 0.95 PGR (0.69) PGRARCHRM1NR3C2NR3C1
SCHEMBL10408759 0.95 HIF1A (0.63) PGRARCHRM1NR3C2NR3C1
SCHEMBL10408598 0.94 PGR (0.61) PGRARCHRM1NR3C2NR3C1
SCHEMBL10408599 0.94 PGR (0.61) PGRARCHRM1NR3C2NR3C1

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
EP-0054786-A1 6-Alpha-methyl hydrocortisone derivatives, their preparation and their utilization SCHERING AKTIENGESELLSCHAFT (DE) 1982-06-30 — — EP claimed
US-4912098-A Antiinflammatory 6 alpha-methylhydrocortisones SCHERING AKTIENGESELLSCHAFT (DE) 1990-03-27 — — US disclosed
EP-0054786-A1 6-Alpha-methyl hydrocortisone derivatives, their preparation and their utilization SCHERING AKTIENGESELLSCHAFT (DE) 1982-06-30 — — EP disclosed
Send feedback