SCHEMBL23488237

SCHEMBL23488237

O=C(O)c1ccc(OC(=O)c2cccnc2)nc1

nearest known ligand 0.62

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.62
APP P05067 1/20 0.62
GAA P10253 1/20 0.62
HCAR3 P49019 1/20 0.62
HCAR2 Q8TDS4 1/20 0.62
KMT2A Q03164 9/20 0.51
ATM Q13315 1/20 0.51
LMNA P02545 4/20 0.51
MAPT P10636 4/20 0.49
CYP1A2 P05177 2/20 0.49
CYP2C9 P11712 2/20 0.49
TSHR P16473 2/20 0.49
CYP2C19 P33261 2/20 0.49
KDM4E B2RXH2 1/20 0.49
THRB P10828 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
CYP3A4 P08684 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
SCHEMBL23488402 0.87 F7 (0.63) ALDH1A1KMT2AATMLMNAMAPT
SCHEMBL23486304 0.86 MAPT (0.56) ALDH1A1APPGAAHCAR3HCAR2
SCHEMBL9261278 0.80 ALDH1A1 (0.56) ALDH1A1KMT2AATMLMNAMAPT
SCHEMBL23488239 0.80 KMT2A (0.72) ALDH1A1APPGAAHCAR3HCAR2
SCHEMBL18922753 0.79 NAPRT (0.69) ALDH1A1GAALMNAMAPTCYP1A2
Niacin SCHEMBL1433 0.79
Niacin SCHEMBL29349574 0.79
Niacin SCHEMBL29396199 0.79 ALDH1A1 (1.00) ALDH1A1APPGAAHCAR3HCAR2
Niacin SCHEMBL3081560 0.79 ALDH1A1 (1.00) ALDH1A1APPGAAHCAR3HCAR2
Niacin SCHEMBL30844065 0.79

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-20210170033-A1 NOVEL CONJUGATES OF A PHARMACEUTICAL AGENT AND A MOIETY CAPABLE OF BINDING TO A GLUCOSE SENSING PROTEIN SANOFI (FR) 2021-06-10 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-20210170033-A1 NOVEL CONJUGATES OF A PHARMACEUTICAL AGENT AND A MOIETY CAPABLE OF BINDING TO A GLUCOSE SENSING PROTEIN GPR119, SLC2A8, SLC2A4 ALDH1A1 1627/4885APP 3466/4885GAA 185/4885

“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.