SCHEMBL29907442

SCHEMBL29907442

CC(C)(O)c1ccc(NC(=O)c2cccn(-c3ccc(F)cc3OCC(F)F)c2=O)cc1

nearest known ligand 0.66

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
UGCG Q16739 4/20 0.66
MET P08581 11/20 0.41
NPC1 O15118 1/20 0.41
KMT2A Q03164 1/20 0.41
AXL P30530 5/20 0.41
RIPK3 Q9Y572 2/20 0.41
TYRO3 Q06418 3/20 0.40
MERTK Q12866 3/20 0.40
ABL1 P00519 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
RIPK2 O43353 1/20 0.39
AHR P35869 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
SCHEMBL29907613 0.89 UGCG (0.83) UGCGMETNPC1KMT2AAXL
SCHEMBL29907576 0.87 UGCG (0.72) UGCGMETNPC1KMT2AAXL
SCHEMBL29907405 0.82 UGCG (0.65) UGCGMETNPC1KMT2AAXL
SCHEMBL29907357 0.82 UGCG (0.70) UGCGMETNPC1KMT2AAXL
SCHEMBL29907462 0.82 UGCG (0.83) UGCGMETAXLRIPK3TYRO3
SCHEMBL24464332 0.82 UGCG (0.53) UGCGMETAXLRIPK3CYP3A4
SCHEMBL29907685 0.80 UGCG (0.69) UGCGMETNPC1KMT2AAXL
SCHEMBL24464304 0.79 UGCG (0.58) UGCGMETNPC1KMT2AAXL
SCHEMBL24464290 0.79 UGCG (0.89) UGCGMETNPC1KMT2AAXL
SCHEMBL29907361 0.79 UGCG (0.89) UGCGMETNPC1KMT2AAXL

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 10/4885MET 4830/4885NPC1 226/4885

“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.