SCHEMBL8750472

SCHEMBL8750472

CCC1=CC(=O)C=C2CC[C@@H]3[C@H](C(O)C[C@@]4(C)[C@H]3CC[C@]4(O)C(=O)COC(C)=O)[C@@]12C

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HIF1A Q16665 12/20 0.72
▸ PGR P06401 5/20 0.72
▸ AR P10275 4/20 0.68
▸ LMNA P02545 3/20 0.68
▸ SERPINA6 P08185 2/20 0.68
▸ CHRM1 P11229 2/20 0.68
▸ SMN1; SMN2 Q16637 2/20 0.57
▸ CYP3A4 P08684 4/20 0.56
▸ F2 P00734 1/20 0.56
▸ HSD17B10 Q99714 3/20 0.55
▸ CYP2C19 P33261 3/20 0.55
▸ NR3C1 P04150 2/20 0.55
▸ ABCB11 O95342 1/20 0.55
▸ TNF P01375 1/20 0.55
▸ IL6 P05231 1/20 0.55
▸ NR3C2 P08235 1/20 0.55
▸ GLUL P15104 1/20 0.55
▸ ADAM17 P78536 1/20 0.55
▸ GPBAR1 Q8TDU6 1/20 0.55
▸ POLB P06746 1/20 0.54

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
SCHEMBL1032200 0.92 HIF1A (0.68) HIF1APGRARLMNASERPINA6
SCHEMBL11876524 0.90 HIF1A (0.68) HIF1APGRARLMNASERPINA6
SCHEMBL13232 0.90 HIF1A (0.74) HIF1APGRARLMNASERPINA6
SCHEMBL10428758 0.89 HIF1A (0.73) HIF1APGRARLMNASERPINA6
SCHEMBL31723329 0.89 HIF1A (0.69) HIF1APGRARLMNASERPINA6
SCHEMBL1938519 0.89 HIF1A (0.69) HIF1APGRARLMNASERPINA6
SCHEMBL5712429 0.88 HIF1A (0.74) HIF1APGRARLMNASERPINA6
SCHEMBL5087747 0.87 HIF1A (0.70) HIF1APGRARLMNASERPINA6
Prednisolone Acetate SCHEMBL8000 0.83 HIF1A (1.00) HIF1APGRARLMNASERPINA6
Prednisolone Acetate SCHEMBL13044467 0.83 HIF1A (1.00) HIF1APGRARLMNASERPINA6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2961398-A1 MOBILIZING AGENTS AND USES THEREFOR Mater Medical Research Institute Limited (AU) 2016-01-06 — — EP disclosed
WO-2014132100-A1 MOBILIZING AGENTS AND USES THEREFOR MATER MEDICAL RESEARCH INSTITUTE LIMITED (AU) 2014-09-04 — — WO disclosed
EP-2734211-A1 ADENINE DERIVATIVES HAVING IMMUNOMODULATING ANTI-INFLAMMATORY AND ANALGESIC ACTIVITY Medestea Research & Production S.p.A. (IT) 2014-05-28 — — EP disclosed
WO-2013011489-A1 ADENINE DERIVATIVES HAVING IMMUNOMODULATING ANTI-INFLAMMATORY AND ANALGESIC ACTIVITY MEDESTEA RESEARCH & PRODUCTION S.P.A. (IT) 2013-01-24 — — WO disclosed
EP-0765171-A1 TREATMENT OF AUTOIMMUNE AND INFLAMMATORY DISORDERS THE KENNEDY INSTITUTE OF RHEUMATOLOGY (GB) 1997-04-02 — — EP disclosed
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