SCHEMBL25657668

SCHEMBL25657668

Cc1ccc(C(OC(=O)[C@@H]2CCCC[C@H]2NC(=O)OCC2c3ccccc3-c3ccccc32)(c2ccccc2)c2ccccc2Cl)cc1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ FABP5 Q01469 3/20 0.38
▸ FABP7 O15540 2/20 0.38
▸ KMT2A Q03164 2/20 0.36
▸ TAS1R3 Q7RTX0 1/20 0.34
▸ TAS1R1 Q7RTX1 1/20 0.34
▸ MDM2 Q00987 1/20 0.34
▸ CTSB P07858 2/20 0.33
▸ CTSS P25774 2/20 0.33
▸ CTSK P43235 2/20 0.33
▸ CPB1 P15086 1/20 0.33
▸ CTSL P07711 1/20 0.33
▸ MDM4 O15151 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ EPHX2 P34913 1/20 0.33
▸ CASP3 P42574 1/20 0.33
▸ F10 P00742 1/20 0.32

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
SCHEMBL25657669 0.98 FABP5 (0.38) FABP5FABP7KMT2ATAS1R3TAS1R1
SCHEMBL25658608 0.91 FABP7 (0.37) FABP5FABP7KMT2ACTSBCTSS
SCHEMBL25658612 0.90 FABP7 (0.36) FABP5FABP7KMT2ACTSBCTSS
SCHEMBL25658613 0.90 FABP7 (0.36) FABP5FABP7KMT2ACTSBCTSS
SCHEMBL25658609 0.87 FABP7 (0.34) FABP5FABP7KMT2AMDM2
SCHEMBL12619416 0.81 KMT2A (0.43) FABP5FABP7KMT2AMDM2MDM4
SCHEMBL14493095 0.81 KMT2A (0.43) FABP5FABP7KMT2AMDM2MDM4
SCHEMBL26449252 0.80 FABP7 (0.38) FABP5FABP7KMT2ACTSBCTSS
SCHEMBL25657687 0.78 KMT2A (0.48) FABP5FABP7KMT2AMDM2MDM4
SCHEMBL24414076 0.77 CASP3 (0.41) FABP5FABP7KMT2AMDM2MDM4

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 FABP5 4094/4885FABP7 4602/4885KMT2A 3145/4885

“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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