SCHEMBL24792918

SCHEMBL24792918

CC(C)(C)OC(=O)N1C[C@@H]2CCCN(c3ccc4[nH]c(=O)oc4c3)[C@@H]2C1

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.41
ENPP2 Q13822 2/20 0.39
LIPE Q05469 2/20 0.39
USP30 Q70CQ3 2/20 0.39
PDE4B Q07343 1/20 0.38
GPR119 Q8TDV5 3/20 0.38
KMT2A Q03164 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
SCHEMBL24792914 0.83 CREBBP (0.41) LIPEGPR119
SCHEMBL29709817 0.83 CREBBP (0.41) LIPEGPR119
SCHEMBL24794687 0.82 TP53 (0.42) LIPEUSP30
SCHEMBL24792917 0.82 NR1H2 (0.47) EPHX2ENPP2KMT2A
SCHEMBL24794177 0.77 ALDH1A1 (0.50) GPR119
SCHEMBL24793521 0.77 HDAC1 (0.42) LIPEUSP30PDE4BGPR119
SCHEMBL24793552 0.77 PDE4B (0.50) EPHX2ENPP2USP30PDE4B
SCHEMBL24794727 0.76 CREBBP (0.40) EPHX2ENPP2
SCHEMBL29709668 0.76 CREBBP (0.40) EPHX2ENPP2
SCHEMBL24792916 0.74 HTR2A (0.45) KMT2A

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-20220402901-A1 SUBSTITUTED N-HETEROCYCLIC CARBOXAMIDES AS ACID CERAMIDASE INHIBITORS AND THEIR USE AS MEDICAMENTS BIAL R&D INVEST S A (PT) 2022-12-22 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-20220402901-A1 SUBSTITUTED N-HETEROCYCLIC CARBOXAMIDES AS ACID CERAMIDASE INHIBITORS AND THEIR USE AS MEDICAMENTS ASAH2, ASAH1, GBA1 EPHX2 607/4885ENPP2 48/4885LIPE 403/4885

“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.