SCHEMBL15904751

SCHEMBL15904751

CC12CCC(=O)C=C1CCC1C2C(O)CC2(C)C1CCC2(O)C(O)CO

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 10/20 0.68
NR3C2 P08235 7/20 0.68
SMN1; SMN2 Q16637 4/20 0.68
NR3C1 P04150 3/20 0.68
HSD17B10 Q99714 3/20 0.68
PGR P06401 3/20 0.68
SERPINA6 P08185 3/20 0.68
CYP3A4 P08684 3/20 0.68
CYP2C19 P33261 2/20 0.68
KMT2A Q03164 2/20 0.68
SHBG P04278 2/20 0.68
MAPT P10636 2/20 0.68
NFKB1 P19838 2/20 0.68
LMNA P02545 4/20 0.66
AR P10275 1/20 0.61
CHRM1 P11229 1/20 0.61
BLM P54132 1/20 0.56
CYP2C9 P11712 1/20 0.56
TSHR P16473 1/20 0.56
SLC22A2 O15244 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
SCHEMBL21973842 1.00 HIF1A (0.68) HIF1ANR3C2SMN1; SMN2NR3C1HSD17B10
SCHEMBL19665917 1.00 HIF1A (0.68) HIF1ANR3C2SMN1; SMN2NR3C1HSD17B10
SCHEMBL2903882 1.00 HIF1A (0.68) HIF1ANR3C2SMN1; SMN2NR3C1HSD17B10
SCHEMBL2903879 1.00 HIF1A (0.68) HIF1ANR3C2SMN1; SMN2NR3C1HSD17B10
SCHEMBL14523062 1.00 HIF1A (0.68) HIF1ANR3C2SMN1; SMN2NR3C1HSD17B10
SCHEMBL19665918 1.00 HIF1A (0.68) HIF1ANR3C2SMN1; SMN2NR3C1HSD17B10
SCHEMBL15920472 1.00 HIF1A (0.68) HIF1ANR3C2SMN1; SMN2NR3C1HSD17B10
SCHEMBL17361272 1.00 HIF1A (0.68) HIF1ANR3C2SMN1; SMN2NR3C1HSD17B10
SCHEMBL15920488 0.89 HIF1A (0.67) HIF1ANR3C2SMN1; SMN2NR3C1HSD17B10
SCHEMBL18878439 0.88 HIF1A (0.71) HIF1ANR3C2SMN1; SMN2NR3C1HSD17B10

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
CN-112552364-A Novel 11 beta-hydroxysteroid compounds for use in mitochondrial biogenesis and diseases associated with mitochondrial dysfunction or depletion 司菲埃拉制药私人有限公司 2021-03-26 CN disclosed
EP-3309166-A2 11BETA-HYDROXY-STEROIDS FOR USE IN MITOCHONDRIA BIOGENESIS AND DISEASES ASSOCIATED WITH MITOCHONDRIAL DYSFUNCTION OR DEPLETION Sphaera Pharma Pvt. Ltd. (IN) 2018-04-18 EP disclosed
US-20150376225-A1 NOVEL COMPOUNDS OF 11BETA-HYDROXY-STEROIDS FOR USE IN MITOCHONDRIA BIOGENESIS AND DISEASES ASSOCIATED WITH MITOCHONDRIAL DYSFUNCTION OR DEPLETION EPIRIUM BIO INC. 2015-12-31 US disclosed
EP-2948152-A2 NOVEL COMPOUNDS OF 11BETA-HYDROXY-STEROIDS FOR USE IN MITOCHONDRIA BIOGENESIS AND DISEASES ASSOCIATED WITH MITOCHONDRIAL DYSFUNCTION OR DEPLETION Sphaera Pharma Pvt. Ltd. (IN) 2015-12-02 EP disclosed
WO-2014115167-A2 NOVEL COMPOUNDS OF 11BETA-HYDROXY-STEROIDS FOR USE IN MITOCHONDRIA BIOGENESIS AND DISEASES ASSOCIATED WITH MITOCHONDRIAL DYSFUNCTION OR DEPLETION SPHAERA PHARMA PVT. LTD. (IN) 2014-07-31 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20150376225-A1 NOVEL COMPOUNDS OF 11BETA-HYDROXY-STEROIDS FOR USE IN MITOCHONDRIA BIOGENESIS AND DISEASES ASSOCIATED WITH MITOCHONDRIAL DYSFUNCTION OR DEPLETION CYP27A1, CYP27B1, TFAM HIF1A 446/4885NR3C2 285/4885SMN1; SMN2 623/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.