SCHEMBL31683963

SCHEMBL31683963

CN(CC(=O)NCC(=O)OC(C)(C)C)C(=O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.42
▸ PTPRC P08575 2/20 0.39
▸ EPHX2 P34913 1/20 0.38
▸ FABP5 Q01469 2/20 0.37
▸ FABP7 O15540 1/20 0.37
▸ PRSS1 P07477 1/20 0.36
▸ TPSAB1 Q15661 1/20 0.36

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
SCHEMBL14037416 0.86 KMT2A (0.47) KMT2AEPHX2FABP5FABP7PRSS1
SCHEMBL22814731 0.85 KMT2A (0.43) KMT2AEPHX2FABP5FABP7
SCHEMBL31493935 0.84 KMT2A (0.39) KMT2AEPHX2FABP5FABP7
SCHEMBL15083572 0.84 KMT2A (0.39) KMT2APTPRCEPHX2FABP5FABP7
SCHEMBL27072523 0.82 KMT2A (0.51) KMT2APTPRCEPHX2
SCHEMBL26352259 0.82 KMT2A (0.51) KMT2APTPRCEPHX2
SCHEMBL29616475 0.81 KMT2A (0.54) KMT2APTPRCEPHX2
SCHEMBL19931854 0.81 KMT2A (0.54) KMT2APTPRCEPHX2
SCHEMBL14037399 0.80 KMT2A (0.40) KMT2AEPHX2
SCHEMBL24784818 0.80 KMT2A (0.46) KMT2APTPRCEPHX2

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-12415835-B2 Peptide-compound cyclization method CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2025-09-16 — — 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-12415835-B2 Peptide-compound cyclization method VIP, NGLY1, GLP1R KMT2A 4608/4885PTPRC 2240/4885EPHX2 4051/4885

“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.

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