SCHEMBL23700490

SCHEMBL23700490

N[C@@]1(C(F)(F)F)COc2c1cc([C@@](O)(CNC(=O)c1ccc(OC3CC3)c(OC3CC3)c1)C1CC1)nc2-c1ccc(F)cc1

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 2/20 0.33
EPHX2 P34913 2/20 0.33
GABRA5 P31644 4/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
PDE4D Q08499 4/20 0.32
SLC5A7 Q9GZV3 3/20 0.32
PDE4A P27815 3/20 0.31
PDE4B Q07343 3/20 0.31
PDE4C Q08493 3/20 0.31
BCL9 O00512 2/20 0.31
CTNNB1 P35222 2/20 0.31
CFTR P13569 1/20 0.31

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
SCHEMBL23700496 1.00 ENPP2 (0.33) ENPP2EPHX2GABRA5MEN1KMT2A
SCHEMBL23700494 1.00 ENPP2 (0.33) ENPP2EPHX2GABRA5MEN1KMT2A
SCHEMBL23700528 0.96 EPHX2 (0.35) EPHX2MEN1KMT2APDE4DSLC5A7
SCHEMBL23700530 0.96 EPHX2 (0.35) EPHX2MEN1KMT2APDE4DSLC5A7
SCHEMBL23700531 0.96 EPHX2 (0.35) EPHX2MEN1KMT2APDE4DSLC5A7
SCHEMBL23674682 0.93 GABRA5 (0.34) ENPP2EPHX2GABRA5MEN1KMT2A
SCHEMBL23674680 0.93 GABRA5 (0.34) ENPP2EPHX2GABRA5MEN1KMT2A
SCHEMBL23674683 0.93 GABRA5 (0.34) ENPP2EPHX2GABRA5MEN1KMT2A
SCHEMBL23717052 0.92 EPHX2 (0.34) EPHX2MEN1KMT2APDE4DSLC5A7
SCHEMBL23717053 0.92 EPHX2 (0.34) EPHX2MEN1KMT2APDE4DSLC5A7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11420976-B2 Heterocyclic compounds as anti-viral agents ENANTA PHARMACEUTICALS, INC. (US) 2022-08-23 US disclosed
US-11420976-B2 Heterocyclic compounds as anti-viral agents ENANTA PHARMACEUTICALS, INC. (US) 2022-08-23 US disclosed
US-20210238188-A1 HETEROCYCLIC COMPOUNDS AS ANTI-VIRAL AGENTS ENANTA PHARMACEUTICALS, INC. 2021-08-05 US disclosed
US-20210238188-A1 HETEROCYCLIC COMPOUNDS AS ANTI-VIRAL AGENTS ENANTA PHARMACEUTICALS, INC. 2021-08-05 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 (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-20210238188-A1 HETEROCYCLIC COMPOUNDS AS ANTI-VIRAL AGENTS VIP, ACE, FURIN ENPP2 518/4885EPHX2 833/4885GABRA5 3187/4885
US-11420976-B2 Heterocyclic compounds as anti-viral agents VIP, ACE, FURIN ENPP2 518/4885EPHX2 833/4885GABRA5 3187/4885

“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.