SCHEMBL16756016

SCHEMBL16756016

COc1ccc2[nH]c(CCCO)cc2c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 3/20 0.66
LOXL2 Q9Y4K0 1/20 0.63
MTNR1B P49286 2/20 0.61
HRH3 Q9Y5N1 3/20 0.59
AXL P30530 1/20 0.53
PDGFRB P09619 2/20 0.51
PDGFRA P16234 2/20 0.51
GHSR Q92847 1/20 0.48
KDM4E B2RXH2 4/20 0.48
ALDH1A1 P00352 3/20 0.48
NPC1 O15118 2/20 0.48
RAB9A P51151 2/20 0.48
LMNA P02545 1/20 0.48
HPGD P15428 1/20 0.48
HTT P42858 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
POLB P06746 1/20 0.47
GAA P10253 1/20 0.47
MAPT P10636 2/20 0.47
MEN1 O00255 2/20 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
SCHEMBL5359941 0.94 MTNR1A (0.63) MTNR1ALOXL2MTNR1BHRH3AXL
SCHEMBL5359373 0.94 MTNR1A (0.63) MTNR1ALOXL2MTNR1BHRH3AXL
SCHEMBL11622077 0.84 LOXL2 (0.71) MTNR1ALOXL2MTNR1BHRH3AXL
SCHEMBL867547 0.84 LOXL2 (0.75) MTNR1ALOXL2MTNR1BHRH3AXL
SCHEMBL7952644 0.83 LOXL2 (0.69) MTNR1ALOXL2MTNR1BHRH3AXL
SCHEMBL28379600 0.81 LOXL2 (0.67) MTNR1ALOXL2MTNR1BHRH3AXL
SCHEMBL6803154 0.81 LOXL2 (0.77) MTNR1ALOXL2MTNR1BHRH3AXL
SCHEMBL9197050 0.81 LOXL2 (0.58) MTNR1ALOXL2MTNR1BHRH3AXL
SCHEMBL8946252 0.81 MTNR1A (0.67) MTNR1ALOXL2MTNR1BHRH3AXL
SCHEMBL2157095 0.79 LOXL2 (0.73) MTNR1ALOXL2MTNR1BHRH3AXL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118978527-A Delta-carboline compound and synthetic method and application thereof 中国科学院成都生物研究所 2024-11-19 CN disclosed
US-9061994-B1 Materials and methods useful to induce vacuolization, cell death, or a combination thereof THE UNIVERSITY OF TOLEDO (US) 2015-06-23 US disclosed
US-20150152049-A1 Materials And Methods Useful To Induce Vacuolization, Cell Death, Or A Combination Thereof THE UNIVERSITY OF TOLEDO (US) 2015-06-04 US 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-20150152049-A1 Materials And Methods Useful To Induce Vacuolization, Cell Death, Or A Combination Thereof BECN1, BAD, BAX MTNR1A 2714/4885LOXL2 1188/4885MTNR1B 3049/4885

“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.