SCHEMBL5738313

SCHEMBL5738313

Fc1ccc(-n2ccc3cc(OCCCCN4CCC4)ccc32)cc1

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 3/20 0.57
SLC6A2 P23975 3/20 0.57
SLC6A4 P31645 3/20 0.57
MEN1 O00255 1/20 0.57
LMNA P02545 1/20 0.57
HTT P42858 1/20 0.57
KMT2A Q03164 1/20 0.57
HRH3 Q9Y5N1 8/20 0.56
KCNH2 Q12809 1/20 0.53
USP2 O75604 1/20 0.50
ALDH1A1 P00352 1/20 0.50
HPGD P15428 1/20 0.50
HTR1A P08908 1/20 0.49
DRD2 P14416 1/20 0.49
HTR2A P28223 1/20 0.49
HRH1 P35367 1/20 0.49
DRD3 P35462 1/20 0.49
TMEM97 Q5BJF2 1/20 0.49
SIGMAR1 Q99720 1/20 0.49

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
SCHEMBL5736283 0.98 MEN1 (0.61) MCHR1SLC6A2SLC6A4MEN1LMNA
SCHEMBL5737258 0.97 HRH3 (0.62) MCHR1SLC6A2SLC6A4MEN1LMNA
SCHEMBL5737288 0.97 MCHR1 (0.58) MCHR1SLC6A2SLC6A4MEN1LMNA
SCHEMBL5737099 0.96 HRH3 (0.64) MCHR1SLC6A2SLC6A4MEN1LMNA
SCHEMBL5737766 0.96 HRH3 (0.64) MCHR1SLC6A2SLC6A4MEN1LMNA
SCHEMBL5734336 0.94 MCHR1 (0.61) MCHR1SLC6A2SLC6A4MEN1LMNA
SCHEMBL5737519 0.93 MCHR1 (0.60) MCHR1SLC6A2SLC6A4MEN1LMNA
SCHEMBL5737022 0.90 SLC6A2 (0.57) MCHR1SLC6A2SLC6A4MEN1LMNA
SCHEMBL5737362 0.89 SLC6A2 (0.57) MCHR1SLC6A2SLC6A4HRH3
SCHEMBL5736084 0.88 SLC6A2 (0.53) MCHR1SLC6A2SLC6A4MEN1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1349833-B1 INDOLE AND DIHYDROINDOLE DERIVATIVES HOFFMANN LA ROCHE (CH) 2006-04-19 EP disclosed
EP-1349833-A1 INDOLE AND DIHYDROINDOLE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2003-10-08 EP disclosed
US-6503907-B2 Indole derivatives or dihydroindole derivatives or salts are useful for the treatment of diseases associated with 2,3-oxidosqualene-lanosterol cyclase such as gallstone, tumorhypercholesterolemia, hyperlipemia, arterioscerosis etc. HOFFMANN-LA ROCHE INC. 2003-01-07 US disclosed
US-20020103247-A1 Indole derivatives or dihydroindole derivatives or salts are useful for the treatment of diseases associated with 2,3-oxidosqualene-lanosterol cyclase such as gallstone, tumorhypercholesterolemia, hyperlipemia, arterioscerosis etc. HOFFMANN-LA ROCHE INC. 2002-08-01 US disclosed
WO-2002044149-A1 INDOLE AND DIHYDROINDOLE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2002-06-06 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-20020103247-A1 Indole derivatives or dihydroindole derivatives or salts are useful for the treatment of diseases associated with 2,3-oxidosqualene-lanosterol cyclase such as gallstone, tumorhypercholesterolemia, hyperlipemia, arterioscerosis etc. LSS, CYP51A1, DHCR7 MCHR1 587/4885SLC6A2 529/4885SLC6A4 989/4885

“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.