SCHEMBL4449045

SCHEMBL4449045

O=C(O)N1CCC(Oc2ccc(C(=O)N3CC4CCC(CC4)C3)cc2)C1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.50
ALDH1A1 P00352 1/20 0.47
HTT P42858 1/20 0.47
SRD5A2 P31213 1/20 0.47
LMNA P02545 1/20 0.47
HRH3 Q9Y5N1 1/20 0.47
NAMPT P43490 1/20 0.45
SRD5A1 P18405 1/20 0.45
GAA P10253 1/20 0.45
POLB P06746 1/20 0.44
MEN1 O00255 2/20 0.44
ADRB2 P07550 2/20 0.44

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
SCHEMBL240984 0.87 KMT2A (0.51) KMT2AALDH1A1HTTSRD5A2LMNA
SCHEMBL240460 0.83 LMNA (0.59) KMT2AALDH1A1HTTLMNAPOLB
SCHEMBL14647869 0.82 L3MBTL3 (0.52) ALDH1A1HTTLMNAHRH3NAMPT
SCHEMBL912597 0.82 L3MBTL3 (0.52) ALDH1A1HTTLMNAHRH3NAMPT
SCHEMBL239976 0.82 HRH3 (0.48) KMT2AALDH1A1HTTHRH3POLB
SCHEMBL240534 0.81 PRKAA2 (0.49) KMT2AALDH1A1HTTNAMPTPOLB
SCHEMBL13047991 0.81 HRH3 (0.48) KMT2AALDH1A1LMNAHRH3NAMPT
SCHEMBL239977 0.81 KMT2A (0.48) KMT2AALDH1A1LMNAHRH3POLB
SCHEMBL594897 0.80 SRD5A1 (0.45) SRD5A2NAMPTSRD5A1
SCHEMBL594896 0.80 SRD5A1 (0.45) SRD5A2NAMPTSRD5A1

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
EP-2010479-A1 11 BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 ACTIVE COMPOUNDS High Point Pharmaceuticals, LLC (US) 2009-01-07 EP claimed
WO-2007115935-A1 11β-HYDROXYSTEROID DEHYDROGENASE TYPE 1 ACTIVE COMPOUNDS HIGH POINT PHARMACEUTICALS, LLC (US) 2007-10-18 WO claimed
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
EP-2010479-A1 11 BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 ACTIVE COMPOUNDS High Point Pharmaceuticals, LLC (US) 2009-01-07 EP 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 (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-20100292215-A1 11BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 ACTIVE COMPOUNDS HSD11B1, HSD3B1, HSD17B1 KMT2A 3848/4885ALDH1A1 67/4885HTT 3419/4885

“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.