SCHEMBL7108625

SCHEMBL7108625

CC(OC(=O)c1cc(C(=O)OC(C)c2ccco2)cc(C(=O)OC(C)c2ccco2)c1)c1ccco1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
ALOX5 P09917 1/20 0.42
KMT2A Q03164 8/20 0.42
POLB P06746 5/20 0.42
MEN1 O00255 5/20 0.42
ALDH1A1 P00352 3/20 0.42
TDP1 Q9NUW8 2/20 0.42
THRB P10828 1/20 0.42
APEX1 P27695 1/20 0.42
RECQL P46063 1/20 0.42
PKM P14618 1/20 0.42
PTPN1 P18031 1/20 0.42
PTPN7 P35236 1/20 0.42
BLM P54132 1/20 0.42
ESR2 Q92731 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
CA12 O43570 2/20 0.41
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41

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
SCHEMBL1258862 0.79 ALOX5 (0.53) NPC1RAB9AALOX5KMT2APOLB
SCHEMBL28089140 0.77 HCAR2 (0.51) NPC1RAB9AALOX5KMT2APOLB
SCHEMBL30322580 0.76 ALOX5 (0.42) NPC1RAB9AALOX5KMT2APOLB
SCHEMBL27884913 0.75 KMT2A (0.42) NPC1RAB9AALOX5KMT2APOLB
SCHEMBL11047695 0.75 ALOX5 (0.41) ALOX5KMT2APOLBMEN1ALDH1A1
SCHEMBL14073828 0.75 ALOX5 (0.41) NPC1RAB9AALOX5KMT2APOLB
SCHEMBL28089141 0.72 HCAR2 (0.62) ALOX5KMT2APOLBMEN1ALDH1A1
SCHEMBL28453165 0.72 ALDH1A1 (0.41) ALOX5KMT2APOLBMEN1ALDH1A1
Ammonia Solution, Strong SCHEMBL7020677 0.71 HCAR2 (0.60) ALOX5KMT2APOLBMEN1ALDH1A1
SCHEMBL1153462 0.71 ALOX5 (0.41) ALOX5KMT2APOLBMEN1ALDH1A1

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-20040242724-A1 Acid decomposable compound SAITO YUTAKA (JP) 2004-12-02 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-20040242724-A1 Acid decomposable compound DERA, ALDOA, DHPS NPC1 2846/4885RAB9A 1931/4885ALOX5 312/4885

“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.