SCHEMBL20364012

SCHEMBL20364012

NC[C@@H]1C[C@@H](Cc2ccc(-c3cc(Cl)ccc3F)cc2)NC1=O

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.39
ROCK2 O75116 4/20 0.36
MME P08473 7/20 0.34
FFAR4 Q5NUL3 3/20 0.34
PIM1 P11309 2/20 0.34
PIM2 Q9P1W9 2/20 0.34
HTR2A P28223 1/20 0.34
HTR2C P28335 1/20 0.34
HTR2B P41595 1/20 0.34
ROCK1 Q13464 2/20 0.34
LTB4R Q15722 1/20 0.33
LTB4R2 Q9NPC1 1/20 0.33

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
SCHEMBL20364020 0.84 MME (0.36) MAOBROCK2MMEFFAR4ROCK1
SCHEMBL24380861 0.84 MME (0.36) MAOBROCK2MMEFFAR4ROCK1
SCHEMBL24428847 0.84 ROCK2 (0.39) MAOBROCK2MMEFFAR4HTR2A
SCHEMBL16979073 0.78 CHRM1 (0.37) MAOBROCK2FFAR4HTR2AHTR2C
SCHEMBL16979069 0.76 KCNA5 (0.43) MAOBROCK2
SCHEMBL16939702 0.75 ROCK2 (0.34) MAOBROCK2MMEFFAR4PIM1
SCHEMBL24380930 0.75 ROCK2 (0.34) MAOBROCK2MMEFFAR4PIM1
SCHEMBL24381002 0.73 MME (0.34) MMEFFAR4PIM1PIM2
SCHEMBL18595125 0.73 MME (0.34) MMEFFAR4PIM1PIM2
SCHEMBL16974261 0.71 FFAR4 (0.36) ROCK2MMEFFAR4

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-20180193338-A1 NEPRILYSIN INHIBITORS THERAVANCE BIOPHARMA R&D IP, LLC (US) 2018-07-12 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-20180193338-A1 NEPRILYSIN INHIBITORS MME, REN, ACE MAOB 62/4885ROCK2 1055/4885MME 1/4885

“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.