SCHEMBL26508355

SCHEMBL26508355

Cc1ccc2c(c1)CCC2NC(=O)NC[C@H](N)C(=O)OCc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 4/20 0.45
LIPG Q9Y5X9 1/20 0.45
TRPV1 Q8NER1 3/20 0.43
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
ACHE P22303 1/20 0.39
PDE10A Q9Y233 1/20 0.39
KMT2A Q03164 2/20 0.39
POLB P06746 1/20 0.39
TAOK1 Q7L7X3 1/20 0.39
TAOK3 Q9H2K8 1/20 0.39
NPY1R P25929 1/20 0.38
OPRK1 P41145 1/20 0.38
HTT P42858 1/20 0.38
LMNA P02545 2/20 0.37
MEN1 O00255 1/20 0.37
TSHR P16473 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
SCHEMBL23979029 0.89 TRPV1 (0.46) EPHX2LIPGTRPV1CA1CA2
SCHEMBL23978895 0.89 TRPV1 (0.46) EPHX2LIPGTRPV1CA1CA2
SCHEMBL30083831 0.88 EPHX2 (0.58) EPHX2LIPGKMT2ATAOK1TAOK3
SCHEMBL30083826 0.88 EPHX2 (0.58) EPHX2LIPGKMT2ATAOK1TAOK3
SCHEMBL24803485 0.88 EPHX2 (0.58) EPHX2LIPGKMT2ATAOK1TAOK3
SCHEMBL23978767 0.88 EPHX2 (0.58) EPHX2LIPGKMT2ATAOK1TAOK3
SCHEMBL23978772 0.88 EPHX2 (0.58) EPHX2LIPGKMT2ATAOK1TAOK3
SCHEMBL23978826 0.80 HTT (0.54) EPHX2KMT2AHTTMEN1TSHR
SCHEMBL30083834 0.80 HTT (0.54) EPHX2KMT2AHTTMEN1TSHR
SCHEMBL24804276 0.80 HTT (0.54) EPHX2KMT2AHTTMEN1TSHR

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-11643388-B2 Inhibitors of alpha 2 beta 1 integrin and methods of use thereof THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-05-09 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-11643388-B2 Inhibitors of alpha 2 beta 1 integrin and methods of use thereof ITGB1, ITGB2, ITGA2 EPHX2 1037/4885LIPG 2259/4885TRPV1 2681/4885

“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.