SCHEMBL29907403

SCHEMBL29907403

O=C(Nc1ccc(OCC(F)(F)F)nc1)c1cccn(-c2ccc(F)cc2OCC(F)(F)F)c1=O

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
UGCG Q16739 3/20 0.60
AXL P30530 5/20 0.45
MET P08581 8/20 0.44
RIPK3 Q9Y572 1/20 0.43
TRPV1 Q8NER1 2/20 0.43
MRGPRX1 Q96LB2 1/20 0.42
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
SCN5A Q14524 1/20 0.41
SCN9A Q15858 1/20 0.41

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
SCHEMBL24464284 1.00 UGCG (0.60) UGCGAXLMETRIPK3TRPV1
SCHEMBL29907572 0.96 UGCG (0.56) UGCGAXLMETRIPK3TRPV1
SCHEMBL29907343 0.95 UGCG (0.62) UGCGAXLMETRIPK3TRPV1
SCHEMBL29907383 0.94 UGCG (0.56) UGCGAXLMETRIPK3TRPV1
SCHEMBL24464323 0.94 UGCG (0.56) UGCGAXLMETRIPK3TRPV1
SCHEMBL29907608 0.94 UGCG (0.56) UGCGAXLMETRIPK3TRPV1
SCHEMBL29907481 0.94 UGCG (0.58) UGCGAXLMETRIPK3TRPV1
SCHEMBL24464332 0.93 UGCG (0.53) UGCGAXLMETRIPK3TRPV1
SCHEMBL29907619 0.91 UGCG (0.72) UGCGAXLMETRIPK3TRPV1
SCHEMBL24464357 0.89 UGCG (0.60) UGCGAXLMETRIPK3MRGPRX1

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 4241/4885MET 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.