SCHEMBL9963906

SCHEMBL9963906

CC(C)(C)c1cc2n(n1)C[C@H](O)COc1ccccc1-2

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MME P08473 2/20 0.44
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
CYP19A1 P11511 5/20 0.33
PTGS1 P23219 1/20 0.31
PTGS2 P35354 1/20 0.31
GRN P28799 1/20 0.31
SORT1 Q99523 1/20 0.31
MAPK13 O15264 1/20 0.31
MAPK12 P53778 1/20 0.31
MAPK11 Q15759 1/20 0.31
MAPK14 Q16539 1/20 0.31
GRM5 P41594 1/20 0.31
LMNA P02545 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL9963880 1.00 MME (0.44) MMENPC1RAB9ACYP19A1PTGS1
SCHEMBL9963907 1.00 MME (0.44) MMENPC1RAB9ACYP19A1PTGS1
SCHEMBL23119130 0.89 MME (0.43) MMEMAPK13MAPK12MAPK11MAPK14
SCHEMBL21650176 0.89 MME (0.43) MMEMAPK13MAPK12MAPK11MAPK14
SCHEMBL15474173 0.84 MME (0.46) MMECYP19A1SMN1; SMN2
SCHEMBL14978999 0.84 MME (0.46) MMECYP19A1SMN1; SMN2
SCHEMBL15474172 0.84 MME (0.46) MMECYP19A1SMN1; SMN2
SCHEMBL23119120 0.81 MME (0.47) MMECYP19A1
SCHEMBL9979898 0.81 MME (0.46) MMECYP19A1GRM5
SCHEMBL9966174 0.81 MME (0.46) MMECYP19A1GRM5

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 20 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-10336773-B2 Neprilysin inhibitors THERAVANCE BIOPHARMA R&D IP, LLC (US) 2019-07-02 US disclosed
US-20180194776-A1 NEPRILYSIN INHIBITORS THERAVANCE BIOPHARMA R&D IP, LLC (US) 2018-07-12 US disclosed
US-20180194776-A1 NEPRILYSIN INHIBITORS THERAVANCE BIOPHARMA R&D IP, LLC (US) 2018-07-12 US disclosed
US-9845332-B2 Neprilysin inhibitors THERAVANCE BIOPHARMA R&D IP, LLC (US) 2017-12-19 US disclosed
US-9845332-B2 Neprilysin inhibitors THERAVANCE BIOPHARMA R&D IP, LLC (US) 2017-12-19 US disclosed
US-20170320895-A1 NEPRILYSIN INHIBITORS THERAVANCE BIOPHARMA R&D IP, LLC (US) 2017-11-09 US disclosed
US-20170320895-A1 NEPRILYSIN INHIBITORS THERAVANCE BIOPHARMA R&D IP, LLC (US) 2017-11-09 US disclosed
US-9688692-B2 Neprilysin inhibitors THERAVANCE BIOPHARMA R&D IP, LLC (US) 2017-06-27 US disclosed
US-9688692-B2 Neprilysin inhibitors THERAVANCE BIOPHARMA R&D IP, LLC (US) 2017-06-27 US disclosed
US-20170022219-A1 NEPRILYSIN INHIBITORS THERAVANCE BIOPHARMA R&D IP, LLC (US) 2017-01-26 US disclosed
US-20170022219-A1 NEPRILYSIN INHIBITORS THERAVANCE BIOPHARMA R&D IP, LLC (US) 2017-01-26 US disclosed
US-9388145-B2 Neprilysin inhibitors THERAVANCE BIOPHARMA R&D IP, LLC (US) 2016-07-12 US disclosed
US-20160016918-A1 NEPRILYSIN INHIBITORS THERAVANCE BIOPHARMA R&D IP, LLC (US) 2016-01-21 US disclosed
US-9120747-B2 Neprilysin inhibitors THERAVANCE BIOPHARMA R&D IP, LLC (US) 2015-09-01 US disclosed
US-20140046053-A1 NEPRILYSIN INHIBITORS THERAVANCE, INC. (US) 2014-02-13 US disclosed
US-8586536-B2 Neprilysin inhibitors THERAVANCE, INC. (US) 2013-11-19 US disclosed
US-20120157383-A1 NEPRILYSIN INHIBITORS THERAVANCE, INC. (US) 2012-06-21 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 (10 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 MME 1/4885NPC1 194/4885RAB9A 1357/4885
US-20170022219-A1 NEPRILYSIN INHIBITORS MME, REN, ACE MME 1/4885NPC1 194/4885RAB9A 1357/4885
US-10336773-B2 Neprilysin inhibitors MME, REN, ACE MME 1/4885NPC1 194/4885RAB9A 1357/4885
US-20210079017-A1 NEPRILYSIN INHIBITORS MME, REN, ACE MME 1/4885NPC1 194/4885RAB9A 1357/4885
US-20170320895-A1 NEPRILYSIN INHIBITORS MME, REN, ACE MME 1/4885NPC1 194/4885RAB9A 1357/4885
US-20180194776-A1 NEPRILYSIN INHIBITORS MME, REN, ACE MME 1/4885NPC1 194/4885RAB9A 1357/4885
US-20200031847-A1 NEPRILYSIN INHIBITORS MME, REN, ACE MME 1/4885NPC1 194/4885RAB9A 1357/4885
US-20140046053-A1 NEPRILYSIN INHIBITORS MME, REN, ACE MME 1/4885NPC1 194/4885RAB9A 1357/4885
US-20160016918-A1 NEPRILYSIN INHIBITORS MME, REN, ACE MME 1/4885NPC1 194/4885RAB9A 1357/4885
US-20120157383-A1 NEPRILYSIN INHIBITORS MME, REN, ACE MME 1/4885NPC1 194/4885RAB9A 1357/4885

“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.