SCHEMBL25657608

SCHEMBL25657608

CC1OC(=O)[C@H](C)N1C(=O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.42
FABP5 Q01469 3/20 0.41
FABP7 O15540 2/20 0.41
EPHX2 P34913 1/20 0.40
POLB P06746 1/20 0.39
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CASP3 P42574 1/20 0.36
CACNA1G O43497 1/20 0.36
CACNA1H O95180 1/20 0.36
CACNA1I Q9P0X4 1/20 0.36
MDM4 O15151 2/20 0.35
TP53 P04637 2/20 0.35
TSHR P16473 1/20 0.35

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
SCHEMBL27032770 0.83 FABP5 (0.40) KMT2AFABP5FABP7EPHX2POLB
SCHEMBL29828502 0.83 FABP5 (0.40) KMT2AFABP5FABP7EPHX2POLB
SCHEMBL25657610 0.83 FABP5 (0.40) KMT2AFABP5FABP7EPHX2POLB
SCHEMBL24633713 0.83 KMT2A (0.37) KMT2AFABP5FABP7EPHX2POLB
SCHEMBL25657500 0.83 KMT2A (0.40) KMT2AFABP5FABP7EPHX2POLB
SCHEMBL24633588 0.81 KMT2A (0.36) KMT2AFABP5FABP7EPHX2POLB
SCHEMBL25657611 0.80 KMT2A (0.35) KMT2AFABP5FABP7EPHX2POLB
SCHEMBL25657609 0.80 FABP5 (0.38) KMT2AFABP5FABP7EPHX2POLB
SCHEMBL29633792 0.79 NPSR1 (0.41) KMT2AFABP5FABP7EPHX2POLB
SCHEMBL22454760 0.79 NPSR1 (0.41) KMT2AFABP5FABP7EPHX2POLB

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-20230151060-A1 CYCLIC PEPTIDE COMPOUND HAVING KRAS INHIBITORY ACTION CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2023-05-18 US disclosed
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 3145/4885FABP5 4094/4885FABP7 4602/4885

“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.