SCHEMBL4663049

SCHEMBL4663049

O=C1NC(CCc2ccccc2)C(O)=C1C(=O)c1cc2ccccc2cn1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NR0B1 P51843 1/20 0.38
EGFR P00533 2/20 0.37
EGLN1 Q9GZT9 1/20 0.37
LCK P06239 1/20 0.35
LMNA P02545 3/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
TRPM8 Q7Z2W7 1/20 0.34
ALDH1A1 P00352 2/20 0.33
POLB P06746 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
HTT P42858 1/20 0.33
USP30 Q70CQ3 1/20 0.33
DAO P14920 2/20 0.33
DPP4 P27487 1/20 0.33

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
SCHEMBL4241441 0.77 NR0B1 (0.48) NR0B1LMNASMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL4666877 0.76 ALOX5 (0.43) NR0B1LMNASMN1; SMN2L3MBTL1DAO
SCHEMBL4244260 0.74 KMT2A (0.54) NR0B1LMNASMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL4664683 0.74 NR0B1 (0.45) NR0B1LMNASMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL6029314 0.73 EGFR (0.39) EGFREGLN1LCKTRPM8USP30
SCHEMBL4666568 0.72 NR0B1 (0.35) NR0B1LMNASMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL4664915 0.72 NPC1 (0.48) NR0B1LMNASMN1; SMN2ALDH1A1POLB
SCHEMBL4664885 0.72 NR0B1 (0.43) NR0B1LMNASMN1; SMN2ALDH1A1POLB
SCHEMBL4662961 0.71 SMN1; SMN2 (0.41) NR0B1LMNASMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL4664850 0.70 NR0B1 (0.41) NR0B1LMNASMN1; SMN2L3MBTL1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080132562-A1 TETRONIC AND TETRAMIC ACIDS GODEL THIERRY 2008-06-05 US claimed
US-20050119329-A1 Tetronic and tetramic acids HOFFMANN-LA ROCHE INC. 2005-06-02 US claimed
US-20080132562-A1 TETRONIC AND TETRAMIC ACIDS GODEL THIERRY 2008-06-05 US disclosed
US-20050119329-A1 Tetronic and tetramic acids HOFFMANN-LA ROCHE INC. 2005-06-02 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 (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-20080132562-A1 TETRONIC AND TETRAMIC ACIDS BACE1, PSEN1, BACE2 NR0B1 106/4885EGFR 1491/4885EGLN1 4732/4885
US-20050119329-A1 Tetronic and tetramic acids BACE1, PSEN1, BACE2 NR0B1 106/4885EGFR 1491/4885EGLN1 4732/4885

“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.