SCHEMBL29907614

SCHEMBL29907614

O=C(Nc1ccc(C(O)(C(F)F)C(F)F)cc1Cl)c1ccnn(-c2ccccc2OCC(F)F)c1=O

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
UGCG Q16739 3/20 0.53
GRM4 Q14833 3/20 0.36
PTGES O14684 4/20 0.36
MET P08581 1/20 0.36
TP53 P04637 1/20 0.36
SCN9A Q15858 2/20 0.35
LCLAT1 Q6UWP7 2/20 0.35
LMNA P02545 1/20 0.34
PKM P14618 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
IRAK4 Q9NWZ3 1/20 0.34
HSD17B13 Q7Z5P4 1/20 0.34

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
SCHEMBL29907486 0.92 UGCG (0.54) UGCGMETSCN9ALCLAT1
SCHEMBL29907352 0.86 UGCG (0.67) UGCGMETSCN9ALCLAT1
SCHEMBL24464270 0.84 UGCG (0.62) UGCGPTGESMETSCN9ALCLAT1
SCHEMBL29907412 0.84 UGCG (0.62) UGCGPTGESMETSCN9ALCLAT1
SCHEMBL29907369 0.84 UGCG (0.62) UGCGMETTP53SCN9ALCLAT1
SCHEMBL29907379 0.81 UGCG (0.46) UGCGPTGESSCN9A
SCHEMBL29907392 0.80 UGCG (0.79) UGCGMETLCLAT1
SCHEMBL29907363 0.79 SCN9A (0.46) UGCGPTGESSCN9ALCLAT1
SCHEMBL29907372 0.78 UGCG (0.63) UGCGPTGESMETSCN9AIRAK4
SCHEMBL29907394 0.77 UGCG (0.82) UGCGMETLCLAT1LMNANPSR1

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 10/4885GRM4 2346/4885PTGES 3127/4885

“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.