SCHEMBL4734156

SCHEMBL4734156

CC(=O)OCC(=O)[C@@]12OC(C)(C)O[C@@H]1C[C@H]1[C@@H]3C[C@H](F)C4=CC(=O)CC[C@]4(C)[C@@]3(F)[C@@H](O)C[C@@]12C

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR3C1 P04150 9/20 0.72
▸ HIF1A Q16665 7/20 0.72
▸ PGR P06401 6/20 0.72
▸ AR P10275 4/20 0.72
▸ LMNA P02545 4/20 0.72
▸ ALDH1A1 P00352 1/20 0.72
▸ MEN1 O00255 1/20 0.72
▸ KMT2A Q03164 1/20 0.72
▸ CYP3A4 P08684 5/20 0.60
▸ USP2 O75604 2/20 0.60
▸ MAPT P10636 2/20 0.57
▸ HSD17B10 Q99714 1/20 0.57
▸ TDP1 Q9NUW8 1/20 0.57
▸ KDM4E B2RXH2 1/20 0.57
▸ MAPK1 P28482 1/20 0.57
▸ NPSR1 Q6W5P4 2/20 0.55
▸ CNR1 P21554 1/20 0.55
▸ KCNH2 Q12809 1/20 0.55
▸ ABCB11 O95342 1/20 0.52
▸ SMN1; SMN2 Q16637 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
SCHEMBL8204332 0.90 NR3C1 (0.59) NR3C1HIF1APGRARLMNA
SCHEMBL4734726 0.90 NR3C1 (0.70) NR3C1HIF1APGRARLMNA
SCHEMBL7080634 0.89 NR3C1 (0.62) NR3C1HIF1APGRARLMNA
SCHEMBL8502672 0.89 NR3C1 (0.57) NR3C1HIF1APGRARLMNA
SCHEMBL11312288 0.88 HIF1A (0.59) NR3C1HIF1APGRARLMNA
SCHEMBL11791051 0.87 HIF1A (0.58) NR3C1HIF1APGRARLMNA
SCHEMBL8499567 0.86 NR3C1 (0.64) NR3C1HIF1APGRARLMNA
SCHEMBL11870530 0.86 NR3C1 (0.55) NR3C1HIF1APGRARLMNA
SCHEMBL7905893 0.85 NR3C1 (0.58) NR3C1HIF1APGRARLMNA
SCHEMBL6324239 0.85 NR3C1 (0.56) NR3C1HIF1APGRARLMNA

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1680076-B1 PHARMACEUTICAL AND COSMETIC FORMULATIONS FOR TREATING FINGERNAILS BIOEQUAL AG (CH) 2008-07-02 — — EP disclosed
WO-2008049401-A2 NAIL VARNISH FOR COSMETIC AND MEDICAL APPLICATIONS SUSILO RUDY (DE) 2008-05-02 — — WO disclosed
US-20070166249-A1 Pharmaceutical and cosmetic formulations for treating fingernails BIOEQUAL AG (CH) 2007-07-19 — — US disclosed
EP-1143950-B1 TOPICAL APPLICATION PRODUCTS AGAINST ONYCHOMYCOSES BIOEQUAL AG (CH) 2005-03-09 — — EP disclosed
US-6740326-B1 WATER-FREE TOPICAL APPLICATION COMPOSITION FOR TREATMENT OF NAIL DISEASES AND NAIL CARE CONSISTING OF ANTIMYCOTIC AGENT AND LOWER ALKYL ESTER OF LACTIC ACID, MALIC ACID, TARTARIC ACID OR CITRIC ACID AS PENETRATION PROMOTING CARRIER BIOEQUAL AG (CH) 2004-05-25 — — US disclosed
EP-1143950-A3 TOPICAL APPLICATION PRODUCTS IPR-Institute for Pharmaceutical Research AG (CH) 2002-05-15 — — EP disclosed
EP-1143950-A2 TOPICAL APPLICATION PRODUCTS IPR-Institute for Pharmaceutical Research AG (CH) 2001-10-17 — — EP disclosed
WO-2000015202-A2 TOPICAL APPLICATION PRODUCTS IPR-INSTITUTE FOR PHARMACEUTICAL RESEARCH AG (CH) 2000-03-23 — — WO disclosed
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