SCHEMBL3663173

SCHEMBL3663173

[O]CCc1cc2ccccc2[nH]1

nearest known ligand 0.60

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 1/20 0.60
MTNR1A P48039 1/20 0.57
MTNR1B P49286 1/20 0.57
HRH3 Q9Y5N1 3/20 0.56
CHRNA7 P36544 2/20 0.49
AHR P35869 1/20 0.47
HRH4 Q9H3N8 1/20 0.46
FLT3 P36888 1/20 0.46
CYP2A6 P11509 1/20 0.46

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
SCHEMBL7169246 0.87 LOXL2 (0.69) LOXL2MTNR1AMTNR1BHRH3CHRNA7
SCHEMBL31059889 0.87 LOXL2 (0.69) LOXL2MTNR1AMTNR1BHRH3CHRNA7
SCHEMBL28335219 0.85 LOXL2 (0.67) LOXL2MTNR1AMTNR1BHRH3CHRNA7
SCHEMBL4958614 0.84 LOXL2 (0.60) LOXL2MTNR1AMTNR1BHRH3CHRNA7
SCHEMBL6165439 0.84 LOXL2 (0.60) LOXL2MTNR1AMTNR1BHRH3CHRNA7
SCHEMBL3022232 0.83 LOXL2 (0.64) LOXL2MTNR1AMTNR1BHRH3AHR
SCHEMBL6860219 0.83 LOXL2 (0.64) LOXL2MTNR1AMTNR1BHRH3CHRNA7
SCHEMBL29403791 0.83 LOXL2 (0.69) LOXL2MTNR1AMTNR1BHRH3AHR
SCHEMBL401081 0.83 LOXL2 (0.69) LOXL2MTNR1AMTNR1BHRH3AHR
SCHEMBL28338445 0.83 LOXL2 (0.69) LOXL2MTNR1AMTNR1BHRH3AHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115872930-A N-substituted 3,4-dihydroisoquinoline-1 (2H) -ketone derivative, composition thereof and application thereof in medicines 贵州医科大学 2023-03-31 CN claimed
US-9487494-B2 Cyclic hydrocarbon compounds for the treatment of diseases LEO PHARMA A/S (DK) 2016-11-08 US claimed
US-20100317582-A1 NOVEL CYCLIC HYDROCARBON COMPOUNDS FOR THE TREATMENT OF DISEASES LEO PHARMA A/S (DK) 2010-12-16 US claimed
EP-2234961-A2 NOVEL CYCLIC HYDROCARBON COMPOUNDS FOR THE TREATMENT OF DISEASES LEO PHARMA A/S (DK) 2010-10-06 EP claimed
WO-2009065406-A2 NOVEL CYCLIC HYDROCARBON COMPOUNDS FOR THE TREATMENT OF DISEASES LEO PHARMA A/S (DK) 2009-05-28 WO claimed
CN-115872930-A N-substituted 3,4-dihydroisoquinoline-1 (2H) -ketone derivative, composition thereof and application thereof in medicines 贵州医科大学 2023-03-31 CN disclosed
WO-2005025554-A2 DIPEPTIDYL PEPTIDASE IV INHIBITOR JAPAN TOBACCO INC. (JP) 2005-03-24 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-20100317582-A1 NOVEL CYCLIC HYDROCARBON COMPOUNDS FOR THE TREATMENT OF DISEASES ARNT, AHR, CYP27A1 LOXL2 1204/4885MTNR1A 80/4885MTNR1B 67/4885

“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.