SCHEMBL23905654

SCHEMBL23905654

CC(C)(C)OC(=O)NCC(O)(c1cc2c(c(-c3ccc(F)cc3)n1)OC[C@]2(C)C=O)C(F)(F)F

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CFTR P13569 3/20 0.37
GRM2 Q14416 1/20 0.36
RORC P51449 1/20 0.34
PDE3B Q13370 1/20 0.33
PDE3A Q14432 1/20 0.33
HDAC2 Q92769 3/20 0.32
HDAC1 Q13547 2/20 0.32
MIF P14174 1/20 0.32
CTSL P07711 1/20 0.31
CTSB P07858 1/20 0.31
SCN9A Q15858 4/20 0.31
FPR2 P25090 1/20 0.31
POLB P06746 1/20 0.31
GAA P10253 1/20 0.31
LATS1 O95835 1/20 0.30

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
SCHEMBL24987101 1.00 CFTR (0.37) CFTRGRM2RORCPDE3BPDE3A
SCHEMBL23905656 0.91 CFTR (0.37) CFTRGRM2RORCPDE3BPDE3A
SCHEMBL24987997 0.89 GRM2 (0.37) CFTRGRM2RORCPDE3BPDE3A
SCHEMBL31412429 0.89 GRM2 (0.37) CFTRGRM2RORCPDE3BPDE3A
SCHEMBL23196094 0.89 GRM2 (0.37) CFTRGRM2RORCPDE3BPDE3A
SCHEMBL23905474 0.88 CFTR (0.35) CFTRGRM2RORCPDE3BPDE3A
SCHEMBL23904728 0.88 CFTR (0.35) CFTRGRM2RORCPDE3BPDE3A
SCHEMBL23905836 0.86 GRM2 (0.35) CFTRGRM2RORCPDE3BPDE3A
SCHEMBL23905373 0.86 GRM2 (0.35) CFTRGRM2RORCPDE3BPDE3A
SCHEMBL24984865 0.86 CFTR (0.38) CFTRGRM2RORCPDE3BPDE3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022086840-A1 HETEROCYCLIC COMPOUNDS AS ANTI-VIRAL AGENTS ENANTA PHARMACEUTICALS, INC. (US) 2022-04-28 WO disclosed
US-20220119398-A1 HETEROCYCLIC COMPOUNDS AS ANTI-VIRAL AGENTS ENANTA PHARMACEUTICALS, INC. 2022-04-21 US disclosed
WO-2021198981-A1 ANTIVIRAL COMPOUNDS AND USES THEREOF Janssen Biopharma, Inc. (US) 2021-10-07 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 (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-20220119398-A1 HETEROCYCLIC COMPOUNDS AS ANTI-VIRAL AGENTS VIP, ACE, FURIN CFTR 307/4885GRM2 4418/4885RORC 586/4885

“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.