SCHEMBL7612473

SCHEMBL7612473

C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)O)[C@@]3(C)C[C@H](O)[C@@]12F

nearest known ligand 0.85

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR3C1 P04150 8/20 0.85
▸ HIF1A Q16665 8/20 0.80
▸ CYP3A4 P08684 7/20 0.80
▸ HSD17B10 Q99714 4/20 0.80
▸ LMNA P02545 3/20 0.80
▸ CYP2C9 P11712 3/20 0.80
▸ PGR P06401 3/20 0.80
▸ NFKB1 P19838 3/20 0.80
▸ PMP22 Q01453 2/20 0.80
▸ CYP2J2 P51589 1/20 0.80
▸ BLM P54132 1/20 0.80
▸ CYP2C19 P33261 1/20 0.80
▸ TSHR P16473 2/20 0.72
▸ AR P10275 2/20 0.72
▸ MEN1 O00255 1/20 0.72
▸ CYP2D6 P10635 1/20 0.72
▸ KMT2A Q03164 1/20 0.72
▸ APEX1 P27695 1/20 0.72
▸ NPSR1 Q6W5P4 1/20 0.72
▸ IKBKB O14920 1/20 0.72

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
SCHEMBL9114530 1.00 NR3C1 (0.85) NR3C1HIF1ACYP3A4HSD17B10LMNA
SCHEMBL9797346 0.92 HIF1A (0.78) NR3C1HIF1ACYP3A4HSD17B10LMNA
SCHEMBL9797354 0.92 HIF1A (0.78) NR3C1HIF1ACYP3A4HSD17B10LMNA
SCHEMBL11309009 0.92 HIF1A (0.78) NR3C1HIF1ACYP3A4HSD17B10LMNA
SCHEMBL18379414 0.92 NR3C1 (1.00) NR3C1HIF1ACYP3A4HSD17B10LMNA
SCHEMBL3754621 0.92 NR3C1 (1.00) NR3C1HIF1ACYP3A4HSD17B10LMNA
SCHEMBL16718939 0.92 NR3C1 (1.00) NR3C1HIF1ACYP3A4HSD17B10LMNA
SCHEMBL22028449 0.92 NR3C1 (1.00) NR3C1HIF1ACYP3A4HSD17B10LMNA
SCHEMBL19764184 0.92 NR3C1 (1.00) NR3C1HIF1ACYP3A4HSD17B10LMNA
SCHEMBL13929942 0.92 NR3C1 (1.00) NR3C1HIF1ACYP3A4HSD17B10LMNA

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-0902789-B1 ANDROSTENE DERIVATIVES SOFT DRUGS INC (US) 2002-01-23 — — EP disclosed
US-5801165-A Antiinflammatory, immunosuppressive and antialleric 16, 17-alkylidioxy-steroids RHONE-POULENC RORER LIMITED (GB) 1998-09-01 — — US disclosed
EP-0675897-B1 NEW STEROIDS RHONE POULENC RORER LTD (GB) 1997-06-18 — — EP disclosed
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