SCHEMBL16756014

SCHEMBL16756014

CCC(O)c1cc2cc(OC)ccc2[nH]1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AXL P30530 1/20 0.53
PDGFRB P09619 2/20 0.51
PDGFRA P16234 2/20 0.51
LOXL2 Q9Y4K0 1/20 0.51
KDM4E B2RXH2 5/20 0.51
ALDH1A1 P00352 4/20 0.51
NPC1 O15118 2/20 0.51
RAB9A P51151 2/20 0.51
LMNA P02545 1/20 0.51
HPGD P15428 1/20 0.51
HTT P42858 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
POLB P06746 1/20 0.47
GAA P10253 1/20 0.47
MAPT P10636 3/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
FLT3 P36888 5/20 0.46
CA2 P00918 1/20 0.46
MTNR1A P48039 1/20 0.45

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
SCHEMBL8761856 0.84 AXL (0.56) AXLPDGFRBPDGFRALOXL2KDM4E
SCHEMBL8760755 0.83 LOXL2 (0.56) AXLPDGFRBPDGFRALOXL2KDM4E
SCHEMBL30176381 0.79 AXL (0.61) AXLPDGFRBPDGFRALOXL2KDM4E
SCHEMBL12356941 0.79 AXL (0.61) AXLPDGFRBPDGFRALOXL2KDM4E
SCHEMBL24196810 0.78 KDM4E (0.45) KDM4EALDH1A1LMNAHPGDMAPT
SCHEMBL30270489 0.78 KDM4E (0.45) KDM4EALDH1A1LMNAHPGDMAPT
SCHEMBL10435155 0.76 AXL (0.57) AXLPDGFRBPDGFRALOXL2KDM4E
SCHEMBL7267170 0.76 ALOX5 (0.48) PDGFRBPDGFRALOXL2KDM4EALDH1A1
SCHEMBL29875124 0.76 ALOX5 (0.48) PDGFRBPDGFRALOXL2KDM4EALDH1A1
SCHEMBL6859892 0.75 PTGS2 (0.57) AXLPDGFRBPDGFRAKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 AXL 3741/4885PDGFRB 3678/4885PDGFRA 3121/4885

“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.