SCHEMBL6061973

SCHEMBL6061973

CCn1c(-c2ccc3c(c2)OCO3)nnc1C(S)c1ccc(C(=O)O)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.54
ALDH1A1 P00352 5/20 0.44
HPGD P15428 3/20 0.44
POLB P06746 2/20 0.44
MAPT P10636 2/20 0.44
HTT P42858 2/20 0.44
GAA P10253 1/20 0.43
LMNA P02545 3/20 0.43
THRB P10828 1/20 0.42
MAPK1 P28482 1/20 0.41
NPC1 O15118 1/20 0.41
RECQL P46063 1/20 0.41
RAB9A P51151 1/20 0.41
HSD17B10 Q99714 1/20 0.41
SIRT2 Q8IXJ6 1/20 0.41
SIRT1 Q96EB6 1/20 0.41
SRD5A2 P31213 1/20 0.41
KDM4E B2RXH2 1/20 0.41
HSD11B1 P28845 1/20 0.41
MEN1 O00255 1/20 0.40

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
SCHEMBL4201215 0.84 SMN1; SMN2 (0.48) SMN1; SMN2ALDH1A1HPGDMAPTHTT
SCHEMBL6061975 0.78 SMN1; SMN2 (0.67) SMN1; SMN2ALDH1A1HPGDPOLBMAPT
SCHEMBL1544495 0.72 SMN1; SMN2 (0.58) SMN1; SMN2ALDH1A1HPGDPOLBMAPT
SCHEMBL13832085 0.69 SMN1; SMN2 (0.67) SMN1; SMN2ALDH1A1MAPTHTTGAA
SCHEMBL2945422 0.69 ALDH1A1 (0.73) SMN1; SMN2ALDH1A1POLBMAPTGAA
SCHEMBL12797796 0.69 NPC1 (0.65) SMN1; SMN2ALDH1A1HPGDPOLBMAPT
SCHEMBL4202749 0.69 SMN1; SMN2 (0.64) SMN1; SMN2ALDH1A1HPGDPOLBMAPT
SCHEMBL13832260 0.67 SMN1; SMN2 (0.71) SMN1; SMN2ALDH1A1HPGDPOLBMAPT
SCHEMBL17159778 0.67 HSD11B1 (0.54) SMN1; SMN2ALDH1A1HPGDGAALMNA
SCHEMBL4206719 0.67 SMN1; SMN2 (0.64) SMN1; SMN2ALDH1A1HPGDMAPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060111348-A1 Combination therapy using an 11beta-hydroxysteroid dehydrogenase type 1 inhibitor and an antihypertensive agent for the treatment of metabolic syndrome and related diseases and disorders NOVO NORDISK A/S (DK) 2006-05-25 US claimed

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-20060111348-A1 Combination therapy using an 11beta-hydroxysteroid dehydrogenase type 1 inhibitor and an antihypertensive agent for the treatment of metabolic syndrome and related diseases and disorders HSD11B1, HSD11B2, HSD17B1 SMN1; SMN2 3473/4885ALDH1A1 74/4885HPGD 84/4885

“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.