SCHEMBL11230026

SCHEMBL11230026

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

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PGR P06401 8/20 0.62
▸ AR P10275 4/20 0.62
▸ ABCB11 O95342 3/20 0.60
▸ NR3C1 P04150 8/20 0.52
▸ CYP3A4 P08684 6/20 0.52
▸ ADRA1A P35348 3/20 0.52
▸ ADORA3 P0DMS8 3/20 0.52
▸ LMNA P02545 3/20 0.52
▸ CHRM1 P11229 2/20 0.52
▸ KDM4E B2RXH2 2/20 0.52
▸ HSD17B10 Q99714 2/20 0.52
▸ CYP2C19 P33261 1/20 0.52
▸ HTR1A P08908 1/20 0.52
▸ ADRA2A P08913 1/20 0.52
▸ SLC6A2 P23975 1/20 0.52
▸ SLC6A3 Q01959 1/20 0.52
▸ KCNH2 Q12809 1/20 0.52
▸ NR1I2 O75469 3/20 0.47
▸ NR3C2 P08235 1/20 0.47
▸ HIF1A Q16665 4/20 0.45

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
SCHEMBL11811105 0.94 PGR (0.60) PGRARABCB11NR3C1CYP3A4
SCHEMBL11811111 0.94 PGR (0.60) PGRARABCB11NR3C1CYP3A4
SCHEMBL11236533 0.93 PGR (0.64) PGRARABCB11NR3C1CYP3A4
SCHEMBL11127297 0.92 PGR (0.70) PGRARABCB11NR3C1CYP3A4
SCHEMBL11246599 0.92 PGR (0.70) PGRARABCB11NR3C1CYP3A4
SCHEMBL11238292 0.92 PGR (0.60) PGRARABCB11NR3C1CYP3A4
SCHEMBL11246597 0.92 PGR (0.70) PGRARABCB11NR3C1CYP3A4
SCHEMBL10715139 0.91 PGR (0.63) PGRARABCB11NR3C1CYP3A4
SCHEMBL11310688 0.91 PGR (0.59) PGRARABCB11NR3C1CYP3A4
SCHEMBL11237068 0.89 ABCB11 (0.67) PGRARABCB11NR3C1CYP3A4

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-4310466-A ANTIINFLAMMATORY STEROIDS SYNTEX (U.S.A.) INC. (US) 1982-01-12 — — US disclosed
US-4263289-A ANTIINFLAMMATORY STEROIDS SYNTEX (U.S.A.) INC. (US) 1981-04-21 — — US disclosed
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