SCHEMBL25264153

SCHEMBL25264153

COC(=O)N(c1ccccc1CCC(=O)O)C1c2ccccc2-c2ccccc21

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PTGER4 P35408 7/20 0.39
▸ PTGER3 P43115 7/20 0.39
▸ PTGER2 P43116 7/20 0.39
▸ PTGER1 P34995 6/20 0.39
▸ FFAR1 O14842 5/20 0.37
▸ FFAR4 Q5NUL3 4/20 0.37
▸ KMT2A Q03164 1/20 0.36
▸ CYP2D6 P10635 1/20 0.35
▸ SLC6A2 P23975 1/20 0.35
▸ SLC6A4 P31645 1/20 0.35
▸ SLC6A3 Q01959 1/20 0.35
▸ KEAP1 Q14145 1/20 0.35
▸ NFE2L2 Q16236 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ LMNA P02545 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
SCHEMBL25173042 0.93 PTGER1 (0.39) PTGER4PTGER3PTGER2PTGER1FFAR1
SCHEMBL9171866 0.75 PTGDR2 (0.39) PTGER4PTGER3PTGER2PTGER1ALDH1A1
SCHEMBL31355071 0.75 KMT2A (0.40) KMT2ACYP2D6SLC6A2SLC6A4SLC6A3
SCHEMBL3202976 0.75 KMT2A (0.40) KMT2ACYP2D6SLC6A2SLC6A4SLC6A3
SCHEMBL3725510 0.74 ALDH1A1 (0.35) KMT2AALDH1A1LMNA
SCHEMBL7432374 0.72 ENPP2 (0.43) FFAR1ALDH1A1LMNA
SCHEMBL16718185 0.72 KMT2A (0.43) FFAR4KMT2ACYP2D6SLC6A2SLC6A4
SCHEMBL1001580 0.71 KMT2A (0.45) KMT2ACYP2D6SLC6A2SLC6A4SLC6A3
SCHEMBL31355068 0.71 GPR3 (0.41) KMT2ACYP2D6SLC6A2SLC6A4SLC6A3
SCHEMBL4600049 0.71 GPR3 (0.41) KMT2ACYP2D6SLC6A2SLC6A4SLC6A3

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 PTGER4 4297/4885PTGER3 4475/4885PTGER2 4583/4885

“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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