SCHEMBL21497779

SCHEMBL21497779

N#Cc1ccc(-c2ccccc2OCC(=O)O)cc1

nearest known ligand 0.72

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 13/20 0.72
L3MBTL1 Q9Y468 3/20 0.54
TDP1 Q9NUW8 2/20 0.54
MMP2 P08253 1/20 0.49
LMNA P02545 1/20 0.48
MAPK1 P28482 1/20 0.48
POLB P06746 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
GLA P06280 1/20 0.47
FFAR1 O14842 1/20 0.46

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
SCHEMBL1947848 0.84 L3MBTL1 (0.72) PTGDR2L3MBTL1TDP1LMNAMAPK1
SCHEMBL1753397 0.84 PTGDR2 (1.00) PTGDR2
SCHEMBL30537993 0.81 L3MBTL1 (0.59) PTGDR2L3MBTL1TDP1LMNAMAPK1
SCHEMBL1753771 0.81 PTGDR2 (0.76) PTGDR2TDP1
SCHEMBL2442473 0.80 L3MBTL1 (0.58) PTGDR2L3MBTL1TDP1LMNAMAPK1
SCHEMBL21497776 0.79 KDM4E (0.59) PTGDR2L3MBTL1LMNAMAPK1POLB
SCHEMBL27688196 0.79 L3MBTL1 (0.65) PTGDR2L3MBTL1TDP1LMNAMAPK1
SCHEMBL4284626 0.78 MMP2 (0.71) PTGDR2MMP2POLBFFAR1
SCHEMBL7806644 0.78 PTGDR2 (0.65) PTGDR2L3MBTL1TDP1LMNAMAPK1
SCHEMBL1690406 0.78 PTGDR2 (1.00) PTGDR2

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
US-20210347763-A1 BIARYL PIPERIDINE AMIDE COMPOUNDS AND METHODS OF USE THEREOF ATHENEX, INC. 2021-11-11 US disclosed
US-20200071305-A1 BIARYL PIPERIDINE AMIDE COMPOUNDS AND METHODS OF USE THEREOF OAKTREE FUND ADMINISTRATION, LLC 2020-03-05 US disclosed
US-10450303-B2 Biaryl piperidine amide compounds and methods of use thereof ATHENEX, INC. (US) 2019-10-22 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 (3 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-10450303-B2 Biaryl piperidine amide compounds and methods of use thereof AADAC, PAICS, UGT2B7 PTGDR2 670/4885L3MBTL1 3469/4885TDP1 1861/4885
US-20210347763-A1 BIARYL PIPERIDINE AMIDE COMPOUNDS AND METHODS OF USE THEREOF AADAC, PAICS, UGT2B7 PTGDR2 670/4885L3MBTL1 3469/4885TDP1 1861/4885
US-20200071305-A1 BIARYL PIPERIDINE AMIDE COMPOUNDS AND METHODS OF USE THEREOF AADAC, PAICS, UGT2B7 PTGDR2 670/4885L3MBTL1 3469/4885TDP1 1861/4885

“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.