SCHEMBL20029205

SCHEMBL20029205

Cc1nc(-c2cccc(NC(=O)C(=O)OCc3ccccc3)c2)no1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.54
TP53 P04637 5/20 0.52
POLB P06746 2/20 0.52
MGLL Q99685 2/20 0.50
HAVCR2 Q8TDQ0 4/20 0.48
RAB9A P51151 2/20 0.48
LMNA P02545 2/20 0.48
MAPK1 P28482 2/20 0.48
HTT P42858 2/20 0.48
NPC1 O15118 1/20 0.48
GAA P10253 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.47
FFAR4 Q5NUL3 1/20 0.47
ENPP2 Q13822 2/20 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
SCHEMBL13273862 0.76 MAPT (0.63) MAPTTP53POLBHAVCR2RAB9A
SCHEMBL20143373 0.74 ALDH1A1 (0.62) MAPTPOLBMGLLRAB9ALMNA
SCHEMBL8268112 0.73 MAPT (0.60) MAPTTP53POLBHAVCR2RAB9A
SCHEMBL7056553 0.73 TP53 (0.66) MAPTTP53POLBHAVCR2RAB9A
SCHEMBL7059963 0.73 MAPT (0.53) MAPTTP53POLBHAVCR2RAB9A
SCHEMBL7295341 0.73 SPHK2 (0.59) MAPTTP53RAB9AMAPK1NPC1
SCHEMBL6565112 0.73 L3MBTL1 (0.59) MAPTTP53POLBL3MBTL1FFAR4
SCHEMBL6985892 0.73 L3MBTL1 (0.59) MAPTTP53POLBRAB9AMAPK1
SCHEMBL27612413 0.72 L3MBTL1 (0.62) MAPTTP53POLBHAVCR2RAB9A
SCHEMBL12747582 0.72 L3MBTL1 (0.62) MAPTTP53POLBRAB9AMAPK1

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-20180093981-A1 2-Acylaminopropoanol-Type Glucosylceramide Synthase Inhibitors GENZYME CORPORATION 2018-04-05 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-20180093981-A1 2-Acylaminopropoanol-Type Glucosylceramide Synthase Inhibitors ASAH2, GBA1, GAA MAPT 2401/4885TP53 4477/4885POLB 2376/4885

“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.