SCHEMBL11430689

SCHEMBL11430689

CCOC(=O)O[C@]1(C(=O)COS(=O)(=O)c2ccc(C)cc2)CC[C@H]2[C@@H]3CCC4=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 5/20 0.65
▸ AR P10275 2/20 0.65
▸ CHRM1 P11229 2/20 0.65
▸ NR3C2 P08235 8/20 0.61
▸ NR3C1 P04150 4/20 0.60
▸ HIF1A Q16665 8/20 0.59
▸ KMT2A Q03164 2/20 0.59
▸ CYP3A4 P08684 3/20 0.56
▸ LMNA P02545 2/20 0.56
▸ USP2 O75604 1/20 0.56
▸ CYP2D6 P10635 1/20 0.56
▸ CYP2C9 P11712 1/20 0.56
▸ SERPINA6 P08185 2/20 0.55
▸ CYP2C19 P33261 2/20 0.53
▸ HSD17B10 Q99714 2/20 0.53
▸ SHBG P04278 1/20 0.53
▸ MAPT P10636 1/20 0.53
▸ NFKB1 P19838 1/20 0.53
▸ SMN1; SMN2 Q16637 1/20 0.53
▸ PMP22 Q01453 1/20 0.52

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
SCHEMBL11437044 0.96 PGR (0.61) PGRARCHRM1NR3C2NR3C1
SCHEMBL11431262 0.95 HIF1A (0.61) PGRARCHRM1NR3C2NR3C1
SCHEMBL11431223 0.95 NR3C2 (0.61) PGRARCHRM1NR3C2NR3C1
SCHEMBL11424725 0.94 PGR (0.63) PGRARCHRM1NR3C2NR3C1
SCHEMBL11437616 0.94 NR3C2 (0.60) PGRARCHRM1NR3C2NR3C1
SCHEMBL11430610 0.90 PGR (0.69) PGRARCHRM1NR3C2NR3C1
SCHEMBL11421975 0.90 PGR (0.61) PGRARCHRM1NR3C2NR3C1
SCHEMBL11433244 0.89 HIF1A (0.61) PGRARCHRM1NR3C2NR3C1
SCHEMBL11425586 0.88 NR3C2 (0.61) PGRARCHRM1NR3C2NR3C1
SCHEMBL11424200 0.88 NR3C2 (0.60) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4242334-A ANTIINFLAMMATORY AGENTS; SKIN DISORDERS HOECHST AKTIENGESELLSCHAFT (DE) 1980-12-30 — — US disclosed
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