SCHEMBL30062876

SCHEMBL30062876

O=C(N[C@@H](CC1CCCCC1)C(=O)O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MDM4 O15151 3/20 0.54
▸ TP53 P04637 3/20 0.54
▸ CASP3 P42574 2/20 0.49
▸ TLR2 O60603 4/20 0.49
▸ MDM2 Q00987 4/20 0.47
▸ KMT2A Q03164 1/20 0.46
▸ CTSL P07711 1/20 0.46
▸ CTSB P07858 1/20 0.46
▸ CTSS P25774 1/20 0.46
▸ CTSK P43235 1/20 0.46

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
SCHEMBL178739 1.00 MDM4 (0.54) MDM4TP53CASP3TLR2MDM2
SCHEMBL119686 1.00 MDM4 (0.54) MDM4TP53CASP3TLR2MDM2
SCHEMBL29398457 1.00 MDM4 (0.54) MDM4TP53CASP3TLR2MDM2
SCHEMBL29400667 1.00 MDM4 (0.54) MDM4TP53CASP3TLR2MDM2
SCHEMBL118173 1.00 MDM4 (0.54) MDM4TP53CASP3TLR2MDM2
SCHEMBL23722984 0.99 MDM4 (0.55) MDM4TP53CASP3TLR2MDM2
SCHEMBL119456 0.99 MDM4 (0.55) MDM4TP53CASP3TLR2MDM2
SCHEMBL119459 0.99 MDM4 (0.55) MDM4TP53CASP3TLR2MDM2
SCHEMBL29709621 0.99 MDM4 (0.55) MDM4TP53CASP3TLR2MDM2
SCHEMBL22581595 0.97 MDM4 (0.55) MDM4TP53CASP3TLR2MDM2

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260049101-A1 TOPICAL TREATMENT OF SKIN CANCER USING OLIGOPEPTIDES BACOBA AG (CH) 2026-02-19 — — US disclosed
US-12410212-B2 Cyclic compound having selective KRAS inhibitory effect on HRAS and NRAS CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2025-09-09 — — US disclosed
EP-4592308-A1 CYCLIC COMPOUND HAVING SELECTIVE KRAS INHIBITORY EFFECT ON HRAS AND NRAS CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2025-07-30 — — EP disclosed
US-20240174714-A1 TREATMENT OF SKIN DISORDERS BACOBA AG (CH) 2024-05-30 — — US disclosed
WO-2022234853-A1 CYCLIC COMPOUND HAVING INHIBITORY EFFECT SELECTIVE FOR KRAS BUT NOT FOR HRAS AND NRAS 中外製薬株式会社 2022-11-10 — — WO 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 (3 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-12410212-B2 Cyclic compound having selective KRAS inhibitory effect on HRAS and NRAS KRAS, HRAS, NRAS MDM4 455/4885TP53 8/4885CASP3 2833/4885
US-20240174714-A1 TREATMENT OF SKIN DISORDERS HRH4, NR1H4, NR1H3 MDM4 3823/4885TP53 4245/4885CASP3 2686/4885
US-20260049101-A1 TOPICAL TREATMENT OF SKIN CANCER USING OLIGOPEPTIDES NGLY1, MC1R, EGFR MDM4 2280/4885TP53 190/4885CASP3 1188/4885

“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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