SCHEMBL29907601

SCHEMBL29907601

O=C(Nc1cnn(CC(F)F)c1)c1cccn(-c2ccc(F)cc2OCC(F)(F)F)c1=O

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
UGCG Q16739 3/20 0.53
AXL P30530 6/20 0.39
MRGPRX1 Q96LB2 1/20 0.39
MET P08581 8/20 0.39
RIPK3 Q9Y572 1/20 0.39
GBA1 P04062 1/20 0.38
RIPK1 Q13546 1/20 0.38

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
SCHEMBL29907510 0.94 UGCG (0.54) UGCGAXLMRGPRX1METRIPK3
SCHEMBL29907632 0.92 UGCG (0.55) UGCGAXLMRGPRX1METRIPK3
SCHEMBL29601550 0.90 UGCG (0.53) UGCGAXLMRGPRX1METRIPK3
SCHEMBL29907354 0.89 UGCG (0.54) UGCGAXLMRGPRX1METRIPK3
SCHEMBL29907452 0.88 UGCG (0.51) UGCGAXLMETRIPK3RIPK1
SCHEMBL29907625 0.88 UGCG (0.51) UGCGAXLMRGPRX1METRIPK3
SCHEMBL29907610 0.86 UGCG (0.49) UGCGAXLMRGPRX1MET
SCHEMBL29907373 0.85 UGCG (0.53) UGCGAXLMRGPRX1METRIPK3
SCHEMBL24464357 0.85 UGCG (0.60) UGCGAXLMRGPRX1METRIPK3
SCHEMBL29907478 0.84 UGCG (0.56) UGCGAXLMRGPRX1METRIPK3

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 10/4885AXL 4241/4885MRGPRX1 2038/4885

“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.