SCHEMBL26564769

SCHEMBL26564769

O=C(NCCc1ccc(O)c(C(=O)O)c1)OCc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
HNF4A P41235 1/20 0.54
HTT P42858 1/20 0.52
LCK P06239 2/20 0.51
EGFR P00533 1/20 0.49
L3MBTL1 Q9Y468 2/20 0.48
MAPT P10636 1/20 0.48
MCL1 Q07820 2/20 0.48
KLKB1 P03952 1/20 0.48
CTSB P07858 1/20 0.48
MMP9 P14780 1/20 0.48
DNMT1 P26358 1/20 0.48
DNMT3B Q9UBC3 1/20 0.48
DNMT3L Q9UJW3 1/20 0.48
DNMT3A Q9Y6K1 1/20 0.48
TGM2 P21980 1/20 0.47
TRPV1 Q8NER1 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
KEAP1 Q14145 1/20 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
SCHEMBL7371177 0.88 TRPV1 (0.60) LMNASMN1; SMN2HTTL3MBTL1MAPT
Hydrochloric Acid SCHEMBL4187499 0.87 TRPV1 (0.59) LMNASMN1; SMN2HTTL3MBTL1MAPT
SCHEMBL3627156 0.85 SMN1; SMN2 (0.55) LMNASMN1; SMN2HTTL3MBTL1MAPT
SCHEMBL10601679 0.84 SMN1; SMN2 (0.53) LMNASMN1; SMN2HTTL3MBTL1MAPT
SCHEMBL6560636 0.82 LMNA (0.61) LMNASMN1; SMN2HTTL3MBTL1MAPT
SCHEMBL6554125 0.82 LMNA (0.65) LMNASMN1; SMN2HTTL3MBTL1MAPT
Benzyl Phenethylcarbamate SCHEMBL4287199 0.82 LMNA (0.73) LMNASMN1; SMN2HTTL3MBTL1MAPT
SCHEMBL10792509 0.81 SMN1; SMN2 (0.53) LMNASMN1; SMN2HTTL3MBTL1MAPT
SCHEMBL26564771 0.81 TRPV1 (0.49) LMNASMN1; SMN2TRPV1
SCHEMBL2851561 0.80 LMNA (0.61) LMNASMN1; SMN2HTTL3MBTL1MAPT

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-20230331663-A1 SMALL MOLECULE NICOTINAMIDE ADENINE DINUCLEOTIDE MODULATORS THE CLEVELAND CLINIC FOUNDATION 2023-10-19 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-20230331663-A1 SMALL MOLECULE NICOTINAMIDE ADENINE DINUCLEOTIDE MODULATORS NQO1, NADK, CD38 LMNA 1685/4885SMN1; SMN2 2057/4885HNF4A 3178/4885

“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.