SCHEMBL29601644

SCHEMBL29601644

CCOC(=O)c1ccc(NC(=O)c2cc(C)nn(-c3ccccc3OCC(F)F)c2=O)cc1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.49
MEN1 O00255 3/20 0.49
SMN1; SMN2 Q16637 4/20 0.47
GAA P10253 3/20 0.47
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47
ALDH1A1 P00352 2/20 0.47
TP53 P04637 2/20 0.45
RXFP1 Q9HBX9 2/20 0.45
LMNA P02545 1/20 0.45
MAPT P10636 4/20 0.44
MAOA P21397 1/20 0.44
NR3C1 P04150 1/20 0.44
UGCG Q16739 1/20 0.42
KDM4E B2RXH2 1/20 0.42
HPGD P15428 1/20 0.42

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
SCHEMBL29907563 0.86 TSHR (0.45) MAPTUGCG
SCHEMBL29601829 0.85 UGCG (0.59) UGCG
SCHEMBL29907424 0.85 UGCG (0.51) SMN1; SMN2MAPTUGCG
SCHEMBL29907402 0.84 ALDH1A1 (0.47) KMT2AMEN1SMN1; SMN2NPC1RAB9A
SCHEMBL29907339 0.83 UGCG (0.43) KMT2AMEN1NR3C1UGCG
SCHEMBL29907624 0.82 UGCG (0.44) KMT2AMEN1SMN1; SMN2RXFP1MAPT
SCHEMBL29907665 0.82 UGCG (0.47) SMN1; SMN2RXFP1MAPTUGCG
SCHEMBL29907650 0.80 TSHR (0.41) KMT2AALDH1A1TP53UGCGKDM4E
SCHEMBL29602191 0.78 UGCG (0.46) UGCG
SCHEMBL29907363 0.77 SCN9A (0.46) KMT2AMEN1SMN1; SMN2UGCG

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 2 patents. 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
EP-4005637-A1 HETEROCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2022-06-01 EP 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 KMT2A 540/4885MEN1 2070/4885SMN1; SMN2 71/4885

“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.