SCHEMBL792845

SCHEMBL792845

C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC(O)[C@@]43C)[C@@H]1CC[C@]2(O)C(=O)CO

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 12/20 0.69
HIF1A Q16665 6/20 0.69
SERPINA6 P08185 6/20 0.69
CYP2C19 P33261 5/20 0.69
SHBG P04278 4/20 0.69
SMN1; SMN2 Q16637 4/20 0.69
CYP3A4 P08684 4/20 0.69
LMNA P02545 4/20 0.69
PMP22 Q01453 2/20 0.69
TSHR P16473 2/20 0.69
BLM P54132 2/20 0.69
NR3C1 P04150 7/20 0.58
KMT2A Q03164 3/20 0.58
PGR P06401 3/20 0.58
MAPT P10636 2/20 0.58
NR3C2 P08235 2/20 0.58
NFKB1 P19838 1/20 0.58
ALDH1A1 P00352 3/20 0.56
CYP2D6 P10635 1/20 0.56
KCNA1 Q09470 1/20 0.56

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
SCHEMBL3464883 1.00 HSD17B10 (0.69) HSD17B10HIF1ASERPINA6CYP2C19SHBG
SCHEMBL23645479 1.00 HSD17B10 (0.69) HSD17B10HIF1ASERPINA6CYP2C19SHBG
SCHEMBL2596391 1.00 HSD17B10 (0.69) HSD17B10HIF1ASERPINA6CYP2C19SHBG
SCHEMBL10425177 0.90 HSD17B10 (0.69) HSD17B10HIF1ASERPINA6CYP2C19SHBG
SCHEMBL4622891 0.88 SHBG (0.55) HSD17B10HIF1ASERPINA6CYP2C19SHBG
SCHEMBL3777671 0.88 LMNA (0.67) HSD17B10HIF1ASERPINA6CYP2C19SHBG
SCHEMBL26133325 0.88 SHBG (0.55) HSD17B10HIF1ASERPINA6CYP2C19SHBG
SCHEMBL4622887 0.88 SHBG (0.55) HSD17B10HIF1ASERPINA6CYP2C19SHBG
SCHEMBL3777666 0.88 LMNA (0.67) HSD17B10HIF1ASERPINA6CYP2C19SHBG
SCHEMBL10886530 0.87 HIF1A (0.61) HSD17B10HIF1ASERPINA6CYP2C19SHBG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3350313-A1 DERIVATION OF LIVER ORGANOIDS FROM HUMAN PLURIPOTENT STEM CELLS Agency For Science, Technology And Research (A*star) (SG) 2018-07-25 EP claimed
WO-2017048193-A1 DERIVATION OF LIVER ORGANOIDS FROM HUMAN PLURIPOTENT STEM CELLS AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (A*STAR) (SG) 2017-03-23 WO claimed
EP-0866689-A1 CORTISONE SPRAY FOR TOPICAL ADMINISTRATION VESIFACT AG (CH) 1998-09-30 EP claimed
WO-1997021428-A1 CORTISONE SPRAY FOR TOPICAL ADMINISTRATION VESIFACT AG (CH) 1997-06-19 WO claimed
EP-3851107-A1 HETEROARYL-KETONE FUSED AZADECALIN GLUCOCORTICOID RECEPTOR MODULATORS Corcept Therapeutics Incorporated (US) 2021-07-21 EP disclosed
EP-2783213-A1 METHODS AND COMPOSITIONS FOR DIAGNOSIS AND PROGNOSIS OF RENAL INJURY AND RENAL FAILURE Astute Medical, Inc. (US) 2014-10-01 EP disclosed
EP-2729805-A1 METHODS AND COMPOSITIONS FOR DIAGNOSIS AND PROGNOSIS OF RENAL INJURY AND RENAL FAILURE Astute Medical, Inc. (US) 2014-05-14 EP disclosed
EP-2616044-A1 PHARMACEUTICAL COMPOSITION Cilpa Limited (IN) 2013-07-24 EP disclosed
WO-2013078253-A1 METHODS AND COMPOSITIONS FOR DIAGNOSIS AND PROGNOSIS OF RENAL INJURY AND RENAL FAILURE ASTUTE MEDICAL, INC. (US) 2013-05-30 WO disclosed
WO-2013009572-A1 METHODS AND COMPOSITIONS FOR DIAGNOSIS AND PROGNOSIS OF RENAL INJURY AND RENAL FAILURE ASTUTE MEDICAL, INC. (US) 2013-01-17 WO disclosed
WO-2012035283-A1 PHARMACEUTICAL COMPOSITION CIPLA LIMITED (IN) 2012-03-22 WO disclosed
EP-2201371-A1 HIGH THROUGHPUT ASSAYS FOR INHIBITORS AND ACTIVATORS OF PAQR RECEPTORS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2010-06-30 EP disclosed
WO-2009042561-A1 HIGH THROUGHPUT ASSAYS FOR INHIBITORS AND ACTIVATORS OF PAQR RECEPTORS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2009-04-02 WO disclosed