SCHEMBL12586273

SCHEMBL12586273

O=C(NC1C2CC3CC(C2)CC1C3)C1CCSc2ccccc21

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.47
HSD17B10 Q99714 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
POLB P06746 1/20 0.44
HSD11B1 P28845 3/20 0.43
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43
EPHX2 P34913 2/20 0.42

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
SCHEMBL12586297 0.81 HSD17B10 (0.47) HSD17B10L3MBTL1HSD11B1KMT2AEPHX2
SCHEMBL12586243 0.78 HSD11B1 (0.49) HSD17B10L3MBTL1HSD11B1KMT2AEPHX2
SCHEMBL12586492 0.77 HSD17B10 (0.46) HSD17B10L3MBTL1HSD11B1KMT2AEPHX2
SCHEMBL12586236 0.75 L3MBTL1 (0.44) HSD17B10L3MBTL1HSD11B1KMT2AMEN1
SCHEMBL12586262 0.75 HSD17B10 (0.46) HSD17B10L3MBTL1HSD11B1KMT2AEPHX2
SCHEMBL1844609 0.74 NPC1 (0.48) NPC1POLBKMT2AMEN1
SCHEMBL5395538 0.72 ALDH1A1 (0.50) NPC1POLBKMT2AMEN1
SCHEMBL5387895 0.72 ALDH1A1 (0.50) NPC1POLBKMT2AMEN1
SCHEMBL12586479 0.72 GLS (0.46) HSD17B10L3MBTL1HSD11B1KMT2AMEN1
SCHEMBL4106867 0.70 EPHX2 (0.55) NPC1KMT2AMEN1EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7968601-B2 Treating excess cortisol formation; obesity, cardiovascular disorders, glaucoma, osteoporosis, Alzheimer's Disease; antidiabetic agents JANSSEN PHARMACEUTICA N.V. (BE) 2011-06-28 US disclosed
US-7968601-B2 Treating excess cortisol formation; obesity, cardiovascular disorders, glaucoma, osteoporosis, Alzheimer's Disease; antidiabetic agents JANSSEN PHARMACEUTICA N.V. (BE) 2011-06-28 US disclosed
US-20080096869-A1 ADAMANTYL ACETAMIDES AS 11-BETA HYDROXYSTEROID DEHYDROGENASE INHIBITORS LINDERS JOANNES T M 2008-04-24 US disclosed
US-20080096869-A1 ADAMANTYL ACETAMIDES AS 11-BETA HYDROXYSTEROID DEHYDROGENASE INHIBITORS LINDERS JOANNES T M 2008-04-24 US disclosed
US-7332524-B2 Adamantyl acetamides as 11-beta hydroxysteroid dehydrogenase inhibitors JANSSEN PHARMACEUTICA N.V. (BE) 2008-02-19 US disclosed
US-7332524-B2 Adamantyl acetamides as 11-beta hydroxysteroid dehydrogenase inhibitors JANSSEN PHARMACEUTICA N.V. (BE) 2008-02-19 US 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-20080096869-A1 ADAMANTYL ACETAMIDES AS 11-BETA HYDROXYSTEROID DEHYDROGENASE INHIBITORS DHCR7, HSD3B2, HSD3B1 NPC1 779/4885HSD17B10 9/4885L3MBTL1 2850/4885

“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.