SCHEMBL25658804

SCHEMBL25658804

O=C(CCNC(=O)OCC1c2ccccc2-c2ccccc21)OC(c1ccccc1)(c1ccc(C2CCCCCCCCCCC2)cc1)c1ccccc1Cl

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.44
▸ FABP7 O15540 2/20 0.36
▸ FABP5 Q01469 2/20 0.36
▸ MEN1 O00255 1/20 0.34
▸ OPRD1 P41143 1/20 0.33
▸ FFAR2 O15552 1/20 0.33
▸ KIF11 P52732 1/20 0.33
▸ TLR2 O60603 1/20 0.33
▸ TLR1 Q15399 1/20 0.33
▸ EPHX2 P34913 1/20 0.33
▸ MDM4 O15151 1/20 0.32
▸ TP53 P04637 1/20 0.32
▸ TAOK1 Q7L7X3 1/20 0.31
▸ TAOK3 Q9H2K8 1/20 0.31

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
SCHEMBL23156981 1.00 KMT2A (0.44) KMT2AFABP7FABP5MEN1OPRD1
SCHEMBL25658800 1.00 KMT2A (0.44) KMT2AFABP7FABP5MEN1OPRD1
SCHEMBL25658818 1.00 KMT2A (0.44) KMT2AFABP7FABP5MEN1OPRD1
SCHEMBL25846320 0.93 KMT2A (0.41) KMT2AFABP7FABP5OPRD1FFAR2
SCHEMBL24579138 0.93 KMT2A (0.39) KMT2AFABP7FABP5OPRD1FFAR2
SCHEMBL26045350 0.91 KMT2A (0.39) KMT2AFABP7FABP5MEN1OPRD1
SCHEMBL25846454 0.91 KMT2A (0.39) KMT2AFABP7FABP5MEN1OPRD1
SCHEMBL28773147 0.90 KMT2A (0.53) KMT2AFABP7FABP5OPRD1EPHX2
SCHEMBL25657687 0.87 KMT2A (0.48) KMT2AFABP7FABP5EPHX2MDM4
SCHEMBL23056431 0.85 CASP3 (0.38) FABP7FABP5FFAR2KIF11MDM4

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-20230151060-A1 CYCLIC PEPTIDE COMPOUND HAVING KRAS INHIBITORY ACTION CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2023-05-18 — — 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-20230151060-A1 CYCLIC PEPTIDE COMPOUND HAVING KRAS INHIBITORY ACTION KRAS, NRAS, HRAS KMT2A 3145/4885FABP7 4602/4885FABP5 4094/4885

“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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