SCHEMBL25658700

SCHEMBL25658700

O=C(C[C@H]1CCCCN1C(=O)OCC1c2ccccc2-c2ccccc21)OC(c1ccccc1)(c1ccc(C2CCCCCCCCCC2)cc1)c1ccccc1Cl

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FFAR2 O15552 1/20 0.36
▸ FABP7 O15540 2/20 0.35
▸ FABP5 Q01469 2/20 0.35
▸ KIF11 P52732 1/20 0.33
▸ PARP1 P09874 1/20 0.32
▸ PSEN1 P49768 3/20 0.32
▸ PSEN2 P49810 3/20 0.32
▸ APH1B Q8WW43 3/20 0.32
▸ NCSTN Q92542 3/20 0.32
▸ APH1A Q96BI3 3/20 0.32
▸ PSENEN Q9NZ42 3/20 0.32
▸ HCRTR2 O43614 3/20 0.31
▸ HCRTR1 O43613 1/20 0.31
▸ F10 P00742 1/20 0.31
▸ APP P05067 1/20 0.31
▸ ABHD6 Q9BV23 1/20 0.31
▸ DAGLA Q9Y4D2 1/20 0.31
▸ HRH3 Q9Y5N1 1/20 0.30
▸ TMEM97 Q5BJF2 1/20 0.30
▸ SIGMAR1 Q99720 1/20 0.30

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
SCHEMBL25658698 1.00 FFAR2 (0.36) FFAR2FABP7FABP5KIF11PARP1
SCHEMBL25658708 0.98 FFAR2 (0.36) FFAR2FABP7FABP5KIF11PARP1
SCHEMBL25658705 0.98 FFAR2 (0.36) FFAR2FABP7FABP5KIF11PARP1
SCHEMBL28773187 0.94 FABP7 (0.39) FABP7FABP5PARP1HCRTR2HCRTR1
SCHEMBL25657678 0.91 FABP7 (0.36) FABP7FABP5PARP1PSEN1PSEN2
SCHEMBL25657679 0.88 FABP7 (0.36) FABP7FABP5PARP1HCRTR2
SCHEMBL24579905 0.87 FABP7 (0.37) FFAR2FABP7FABP5KIF11PARP1
SCHEMBL24579138 0.83 KMT2A (0.39) FFAR2FABP7FABP5KIF11
SCHEMBL23156981 0.81 KMT2A (0.44) FFAR2FABP7FABP5KIF11
SCHEMBL22154300 0.81 FABP5 (0.36) FFAR2FABP7FABP5KIF11F10

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 FFAR2 3766/4885FABP7 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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