SCHEMBL29907683

SCHEMBL29907683

COC(C)(C)c1ccc(NC(=O)c2cccn(-c3ccc(F)cc3OCC(F)(F)F)c2=O)cn1

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
UGCG Q16739 4/20 0.60
MRGPRX1 Q96LB2 1/20 0.41
MET P08581 11/20 0.40
RIPK3 Q9Y572 2/20 0.40
RIPK2 O43353 1/20 0.40
RIPK1 Q13546 1/20 0.40
AXL P30530 5/20 0.39
TYRO3 Q06418 2/20 0.39
MERTK Q12866 2/20 0.39
ABL1 P00519 1/20 0.39

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
SCHEMBL29907401 0.92 UGCG (0.66) UGCGMRGPRX1METRIPK3RIPK2
SCHEMBL29907350 0.92 UGCG (0.71) UGCGMETRIPK3RIPK2RIPK1
SCHEMBL29907374 0.89 UGCG (0.58) UGCGMRGPRX1METRIPK3RIPK2
SCHEMBL24464284 0.87 UGCG (0.60) UGCGMRGPRX1METRIPK3AXL
SCHEMBL29907403 0.87 UGCG (0.60) UGCGMRGPRX1METRIPK3AXL
SCHEMBL29907343 0.85 UGCG (0.62) UGCGMRGPRX1METRIPK3RIPK2
SCHEMBL29907483 0.85 UGCG (0.66) UGCGMETRIPK3RIPK2RIPK1
SCHEMBL24464357 0.85 UGCG (0.60) UGCGMRGPRX1METRIPK3RIPK2
SCHEMBL29907608 0.85 UGCG (0.56) UGCGMETRIPK3RIPK2RIPK1
SCHEMBL29907395 0.84 UGCG (0.58) UGCGMRGPRX1METRIPK3RIPK2

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 10/4885MRGPRX1 2038/4885MET 4830/4885

“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.