SCHEMBL29907449

SCHEMBL29907449

O=C(O)c1cccn(-c2ccnnc2OCC(F)(F)F)c1=O

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
UGCG Q16739 2/20 0.42
L3MBTL1 Q9Y468 2/20 0.34
POLB P06746 1/20 0.33
APEX1 P27695 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
NAPRT Q6XQN6 1/20 0.33
HCRTR2 O43614 7/20 0.33
HCRTR1 O43613 6/20 0.33
SSTR4 P31391 1/20 0.32
RXRA P19793 1/20 0.32
HNF4A P41235 1/20 0.32
DGAT1 O75907 1/20 0.31
KDM5B Q9UGL1 1/20 0.30
ENPP2 Q13822 1/20 0.30
CMA1 P23946 1/20 0.30
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL29907573 0.86 UGCG (0.46) UGCGL3MBTL1POLBAPEX1TDP1
SCHEMBL29907586 0.81 UGCG (0.53) UGCGDGAT1
SCHEMBL29907446 0.80 UGCG (0.71) UGCGHCRTR2HCRTR1
SCHEMBL29907518 0.77 UGCG (0.53) UGCG
SCHEMBL29602034 0.77 UGCG (0.55) UGCG
SCHEMBL29907607 0.75 UGCG (0.48) UGCGL3MBTL1POLBAPEX1TDP1
SCHEMBL29907341 0.74 UGCG (0.52) UGCG
SCHEMBL29907649 0.71 UGCG (0.42) UGCGL3MBTL1POLBHCRTR2HCRTR1
SCHEMBL456915 0.70 NAPRT (0.50) L3MBTL1TDP1NAPRTHCRTR2HCRTR1
SCHEMBL30919007 0.70 NAPRT (0.50) L3MBTL1TDP1NAPRTHCRTR2HCRTR1

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-20220289679-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2022-09-15 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-20220289679-A1 HETEROCYCLIC COMPOUND GBA1, GBA2, GALC UGCG 10/4885L3MBTL1 1929/4885POLB 3724/4885

“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.