SCHEMBL31369766

SCHEMBL31369766

CN(C(=O)OCC1c2ccccc2-c2ccccc21)[C@@H](CCc1cccc(F)c1)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
MDM4 O15151 1/20 0.38
TP53 P04637 1/20 0.38
MDM2 Q00987 1/20 0.38
FABP5 Q01469 2/20 0.36
FABP7 O15540 1/20 0.36
KDM4E B2RXH2 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
MAPT P10636 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
TAAR1 Q96RJ0 1/20 0.36
PPARG P37231 1/20 0.35
PPARA Q07869 1/20 0.35
CCR5 P51681 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
SCHEMBL29633822 1.00 EPHX2 (0.39) EPHX2MEN1KMT2AMDM4TP53
SCHEMBL31688690 0.94 KMT2A (0.37) EPHX2MEN1KMT2AMDM4TP53
SCHEMBL31688664 0.92 EPHX2 (0.38) EPHX2KMT2AMDM4TP53MDM2
SCHEMBL29855115 0.90 SLC1A1 (0.40) EPHX2MEN1KMT2AMDM4TP53
SCHEMBL29983403 0.90 SLC1A1 (0.40) EPHX2MEN1KMT2AMDM4TP53
SCHEMBL25172765 0.90 SLC1A1 (0.40) EPHX2MEN1KMT2AMDM4TP53
SCHEMBL31369979 0.90 SLC1A1 (0.40) EPHX2MEN1KMT2AMDM4TP53
SCHEMBL25182245 0.90 SLC1A1 (0.40) EPHX2MEN1KMT2AMDM4TP53
SCHEMBL30889958 0.90 FABP5 (0.41) EPHX2KMT2AFABP5FABP7
SCHEMBL21837960 0.90 FABP5 (0.41) EPHX2KMT2AFABP5FABP7

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-20240400499-A1 NOVEL AMINO ACID DERIVATIVES PEPTIDREAM INC (JP) 2024-12-05 US claimed
US-20240400499-A1 NOVEL AMINO ACID DERIVATIVES PEPTIDREAM INC (JP) 2024-12-05 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-20240400499-A1 NOVEL AMINO ACID DERIVATIVES BCAT1, BCAT2, PELP1 EPHX2 4829/4885MEN1 4354/4885KMT2A 3415/4885

“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.