SCHEMBL4164258

SCHEMBL4164258

Cc1sccc1C(=O)N1CCOCC1

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.57
HTT P42858 2/20 0.53
ALDH1A1 P00352 3/20 0.50
SMN1; SMN2 Q16637 3/20 0.49
GLA P06280 1/20 0.49
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
KDM4E B2RXH2 2/20 0.48
GAA P10253 1/20 0.48
PKM P14618 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
MAPT P10636 1/20 0.47

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
SCHEMBL4150866 0.85 HPGD (0.50) HPGDHTTALDH1A1MEN1KMT2A
SCHEMBL4154038 0.83 HPGD (0.49) HPGDHTTALDH1A1MEN1KMT2A
SCHEMBL7457513 0.81 HPGD (0.56) HPGDHTTALDH1A1SMN1; SMN2MEN1
SCHEMBL7457510 0.78 HPGD (0.49) HPGDHTTALDH1A1SMN1; SMN2GLA
SCHEMBL324878 0.77 ALDH1A1 (0.63) HPGDALDH1A1SMN1; SMN2GLA
SCHEMBL29175534 0.77 SMN1; SMN2 (0.49) HPGDHTTALDH1A1SMN1; SMN2GLA
SCHEMBL10013747 0.73 HTT (0.72) HPGDHTTALDH1A1SMN1; SMN2GAA
SCHEMBL7121916 0.73 SMN1; SMN2 (0.77) HPGDHTTALDH1A1SMN1; SMN2MEN1
SCHEMBL9792238 0.72 HPGD (0.55) HPGDALDH1A1SMN1; SMN2GLANPSR1
SCHEMBL12569441 0.71 PKM (0.60) HTTALDH1A1SMN1; SMN2GAAPKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090105292-A9 Glucocorticoid Receptor Modulator Compounds and Methods LIGAND PHARMACEUTICALS INCORPORATED (US) 2009-04-23 US disclosed
US-20070281959-A1 Glucocorticoid receptor modulator compounds and methods LIGAND PHARMACEUTICALS INCORPORATED (US) 2007-12-06 US disclosed
EP-1718653-A1 GLUCOCORTICOID RECEPTOR MODULATOR COMPOUNDS AND METHODS- UTILITY Ligand Pharmaceuticals Inc. (US) 2006-11-08 EP disclosed
WO-2005082909-A1 GLUCOCORTICOID RECEPTOR MODULATOR COMPOUNDS AND METHODS- UTILITY LIGAND PHARMACEUTICALS INCORPORATED (US) 2005-09-09 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-20090105292-A9 Glucocorticoid Receptor Modulator Compounds and Methods NR3C1, NR3C2, MC2R HPGD 272/4885HTT 4858/4885ALDH1A1 1465/4885
US-20070281959-A1 Glucocorticoid receptor modulator compounds and methods NR3C1, NR3C2, MC2R HPGD 272/4885HTT 4858/4885ALDH1A1 1465/4885

“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.