SCHEMBL18154894

SCHEMBL18154894

C[C@]1(C(=O)O)CCCN1C(=O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.43
FABP5 Q01469 3/20 0.42
FABP7 O15540 2/20 0.42
KMT2A Q03164 2/20 0.40
CASP3 P42574 1/20 0.37

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
SCHEMBL2583787 1.00 EPHX2 (0.43) EPHX2FABP5FABP7KMT2ACASP3
SCHEMBL30792927 1.00 EPHX2 (0.43) EPHX2FABP5FABP7KMT2ACASP3
SCHEMBL30896020 1.00 EPHX2 (0.43) EPHX2FABP5FABP7KMT2ACASP3
SCHEMBL30016334 1.00 EPHX2 (0.43) EPHX2FABP5FABP7KMT2ACASP3
SCHEMBL2583781 1.00 EPHX2 (0.43) EPHX2FABP5FABP7KMT2ACASP3
SCHEMBL30896027 1.00 EPHX2 (0.43) EPHX2FABP5FABP7KMT2ACASP3
SCHEMBL31742570 0.93 EPHX2 (0.44) EPHX2FABP5FABP7KMT2ACASP3
SCHEMBL28365887 0.85 EPHX2 (0.46) EPHX2FABP5FABP7KMT2ACASP3
SCHEMBL6532381 0.83 CASP3 (0.43) EPHX2KMT2ACASP3
SCHEMBL8120555 0.83 EPHX2 (0.44) EPHX2FABP5FABP7KMT2ACASP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4512818-A1 CYCLIC COMPOUND HAVING SELECTIVE KRAS INHIBITORY EFFECT ON HRAS AND NRAS Chugai Seiyaku Kabushiki Kaisha (JP) 2025-02-26 EP disclosed
US-20240158446-A1 CYCLIC COMPOUND HAVING SELECTIVE INHIBITORY ACTION ON KRAS OVER HRAS AND NRAS CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2024-05-16 US disclosed
EP-4309741-A1 CYCLIC COMPOUND HAVING INHIBITORY EFFECT SELECTIVE FOR KRAS BUT NOT FOR HRAS AND NRAS CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2024-01-24 EP disclosed
US-20180099937-A1 NOVEL ARYL-CYANOGUANIDINE COMPOUNDS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2018-04-12 US disclosed
EP-3283480-A1 NOVEL ARYL-CYANOGUANIDINE COMPOUNDS Bayer Pharma Aktiengesellschaft (DE) 2018-02-21 EP disclosed
WO-2016166186-A1 NOVEL ARYL-CYANOGUANIDINE COMPOUNDS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2016-10-20 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 (2 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-20240158446-A1 CYCLIC COMPOUND HAVING SELECTIVE INHIBITORY ACTION ON KRAS OVER HRAS AND NRAS KRAS, HRAS, NRAS EPHX2 3517/4885FABP5 4703/4885FABP7 4408/4885
US-20180099937-A1 NOVEL ARYL-CYANOGUANIDINE COMPOUNDS SMYD2, SETD2, SMYD3 EPHX2 3767/4885FABP5 3856/4885FABP7 4596/4885

“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.