SCHEMBL18640583

SCHEMBL18640583

O=COCc1ccc(C(=O)O)o1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 5/20 0.56
POLB P06746 8/20 0.55
L3MBTL1 Q9Y468 3/20 0.55
MAPT P10636 2/20 0.55
NPC1 O15118 7/20 0.54
RAB9A P51151 7/20 0.54
SMN1; SMN2 Q16637 3/20 0.54
KMT2A Q03164 2/20 0.54
MAPK1 P28482 1/20 0.54
HSD17B10 Q99714 1/20 0.54
KDM4E B2RXH2 1/20 0.50
HSP90AA1 P07900 1/20 0.50
MEN1 O00255 1/20 0.49
MRGPRX4 Q96LA9 1/20 0.49
SENP8 Q96LD8 1/20 0.47
SENP7 Q9BQF6 1/20 0.47
SENP6 Q9GZR1 1/20 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
SCHEMBL21594666 0.81 HTT (0.65) POLBL3MBTL1MAPTNPC1RAB9A
SCHEMBL17537926 0.81 TDP1 (0.64) TDP1POLBL3MBTL1MAPTNPC1
SCHEMBL2540847 0.80 ALDH1A1 (0.35) TDP1POLBL3MBTL1MAPTNPC1
SCHEMBL21594671 0.79 NPC1 (0.56) POLBL3MBTL1MAPTNPC1RAB9A
SCHEMBL19248471 0.79 CA2 (0.38) TDP1POLBL3MBTL1MAPTNPC1
SCHEMBL3191767 0.78 NPC1 (0.61) TDP1POLBL3MBTL1MAPTNPC1
SCHEMBL17537927 0.78 POLB (0.60) TDP1POLBL3MBTL1MAPTNPC1
SCHEMBL21594668 0.78 HTT (0.44) TDP1POLBL3MBTL1NPC1RAB9A
SCHEMBL19248450 0.77 POLB (0.52) TDP1POLBL3MBTL1MAPTNPC1
SCHEMBL21594672 0.77 NPC1 (0.45) TDP1POLBL3MBTL1MAPTNPC1

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
US-10392358-B2 Oxidation chemistry on furan aldehydes MICROMIDAS, INC. (US) 2019-08-27 US disclosed
US-10392358-B2 Oxidation chemistry on furan aldehydes MICROMIDAS, INC. (US) 2019-08-27 US disclosed
US-20180265488-A1 OXIDATION CHEMISTRY ON FURAN ALDEHYDES MICROMIDAS, INC. (US) 2018-09-20 US disclosed
WO-2017049211-A1 OXIDATION CHEMISTRY ON FURAN ALDEHYDES MICROMIDAS, INC. (US) 2017-03-23 WO disclosed
WO-2017049211-A1 OXIDATION CHEMISTRY ON FURAN ALDEHYDES MICROMIDAS, INC. (US) 2017-03-23 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 (2 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-10392358-B2 Oxidation chemistry on furan aldehydes AOX1, ALOX5, CBR1 TDP1 2488/4885POLB 2337/4885L3MBTL1 2764/4885
US-20180265488-A1 OXIDATION CHEMISTRY ON FURAN ALDEHYDES AOX1, ALOX5, CBR1 TDP1 2488/4885POLB 2337/4885L3MBTL1 2764/4885

“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.