SCHEMBL9974770

SCHEMBL9974770

CON1C(=O)[C@H](NC(=O)OC(C)(C)C)Cc2ccc(-c3ccccc3)cc21

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 1/20 0.39
SCN9A Q15858 4/20 0.39
HDAC1 Q13547 1/20 0.37
CKS1B P61024 1/20 0.37
SKP1 P63208 1/20 0.37
SKP2 Q13309 1/20 0.37
EPHX2 P34913 1/20 0.37
USP30 Q70CQ3 2/20 0.37
NPY1R P25929 1/20 0.37
PYGL P06737 3/20 0.36
PYGM P11217 3/20 0.36
ACLY P53396 1/20 0.36
KMT2A Q03164 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL23119152 0.85 GAA (0.38) SCN9AEPHX2NPY1RPYGLPYGM
SCHEMBL7423564 0.84 KYAT1 (0.46) PYGLPYGM
SCHEMBL7419284 0.84 AADAT (0.40) SCN9APYGLPYGM
SCHEMBL3781776 0.82 CCKBR (0.39) PYGLPYGM
SCHEMBL9974767 0.80 DRD2 (0.37) SCN9APYGLPYGM
SCHEMBL5132457 0.77 NPY1R (0.52) SCN9ANPY1RKMT2AL3MBTL1
SCHEMBL3777420 0.77 CCKBR (0.39) PYGLPYGM
SCHEMBL14193208 0.76 PYGL (0.43) PYGLPYGM
SCHEMBL23119153 0.76 NPY1R (0.45) SCN9ANPY1R
SCHEMBL24190214 0.75 GAA (0.38) EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210079017-A1 NEPRILYSIN INHIBITORS THERAVANCE BIOPHARMA R&D IP, LLC (US) 2021-03-18 US disclosed
US-10759813-B2 Neprilysin inhibitors THERAVANCE BIOPHARMA R&D IP, LLC (US) 2020-09-01 US disclosed
US-20200031847-A1 NEPRILYSIN INHIBITORS THERAVANCE BIOPHARMA R&D IP, LLC (US) 2020-01-30 US disclosed
US-20170320895-A1 NEPRILYSIN INHIBITORS THERAVANCE BIOPHARMA R&D IP, LLC (US) 2017-11-09 US disclosed
WO-2012082853-A1 NEPRILYSIN INHIBITORS THERAVANCE, INC. (US) 2012-06-21 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 (4 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-10759813-B2 Neprilysin inhibitors MME, REN, ACE LIPG 1067/4885SCN9A 596/4885HDAC1 1103/4885
US-20210079017-A1 NEPRILYSIN INHIBITORS MME, REN, ACE LIPG 1067/4885SCN9A 596/4885HDAC1 1103/4885
US-20170320895-A1 NEPRILYSIN INHIBITORS MME, REN, ACE LIPG 1067/4885SCN9A 596/4885HDAC1 1103/4885
US-20200031847-A1 NEPRILYSIN INHIBITORS MME, REN, ACE LIPG 1067/4885SCN9A 596/4885HDAC1 1103/4885

“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.