SCHEMBL3265629

SCHEMBL3265629

O=C(c1ccc(O[C@H]2CC[C@@H](NS(=O)(=O)c3ccccn3)CC2)cc1)N1CCCC2CCCCC21

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.47
ALDH1A1 P00352 4/20 0.42
KMT2A Q03164 4/20 0.42
MEN1 O00255 2/20 0.42
MAPT P10636 1/20 0.42
HSD11B1 P28845 7/20 0.42
HSD17B1 P14061 1/20 0.39
POLB P06746 1/20 0.39
CNR2 P34972 1/20 0.38
RAB9A P51151 1/20 0.37

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
SCHEMBL13047981 1.00 NPC1 (0.47) NPC1ALDH1A1KMT2AMEN1MAPT
SCHEMBL237937 0.80 ALDH1A1 (0.42) NPC1ALDH1A1KMT2ARAB9A
SCHEMBL3265557 0.77 EPHX2 (0.49) ALDH1A1KMT2AMEN1MAPTHSD11B1
SCHEMBL14402784 0.76 HSD11B1 (0.53) ALDH1A1KMT2AMEN1MAPTHSD11B1
SCHEMBL240695 0.76 HSD11B1 (0.44) NPC1ALDH1A1HSD11B1HSD17B1CNR2
SCHEMBL239988 0.75 EPHX2 (0.42) NPC1ALDH1A1KMT2AMEN1RAB9A
SCHEMBL239989 0.75 EPHX2 (0.42) NPC1ALDH1A1KMT2AMEN1RAB9A
SCHEMBL3747771 0.74 MAPT (0.49) ALDH1A1KMT2AMEN1MAPTHSD11B1
SCHEMBL240570 0.74 MAPT (0.51) ALDH1A1KMT2AMEN1MAPTHSD11B1
SCHEMBL241413 0.73 MAPT (0.50) ALDH1A1KMT2AMEN1MAPTHSD11B1

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-20120004209-A1 11-Beta-Hydroxysteroid Dehydrogenase Type 1 Active Compounds HIGH POINT PHARMACEUTICALS, LLC (US) 2012-01-05 US disclosed
US-8053447-B2 11β-hydroxysteroid dehydrogenase type 1 active compounds HIGH POINT PHARMACEUTICALS, LLC (US) 2011-11-08 US disclosed
US-8053447-B2 11β-hydroxysteroid dehydrogenase type 1 active compounds HIGH POINT PHARMACEUTICALS, LLC (US) 2011-11-08 US disclosed
US-20100292215-A1 11BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 ACTIVE COMPOUNDS HIGH POINT PHARMACEUTICALS, LLC (US) 2010-11-18 US disclosed
US-20100292215-A1 11BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 ACTIVE COMPOUNDS HIGH POINT PHARMACEUTICALS, LLC (US) 2010-11-18 US disclosed
WO-2007115935-A1 11β-HYDROXYSTEROID DEHYDROGENASE TYPE 1 ACTIVE COMPOUNDS HIGH POINT PHARMACEUTICALS, LLC (US) 2007-10-18 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 (2 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-20120004209-A1 11-Beta-Hydroxysteroid Dehydrogenase Type 1 Active Compounds HSD11B1, HSD3B1, HSD11B2 NPC1 399/4885ALDH1A1 77/4885KMT2A 3823/4885
US-20100292215-A1 11BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 ACTIVE COMPOUNDS HSD11B1, HSD3B1, HSD17B1 NPC1 387/4885ALDH1A1 67/4885KMT2A 3848/4885

“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.