Pyridine

Pyridine

SCHEMBL18957190

CCC(=O)NC1Cc2cccc(C(=O)OCOC(C)=O)c2OB1O.c1ccncc1

nearest known ligand 0.46

Full drug profile on Sugi Atlas →

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MTNR1A P48039 3/20 0.33
▸ MTNR1B P49286 3/20 0.33
▸ CYP1A2 P05177 2/20 0.33
▸ ALOX15 P16050 2/20 0.33
▸ MAPT P10636 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.32
▸ MEN1 O00255 1/20 0.30
▸ CYP3A4 P08684 1/20 0.30
▸ TSHR P16473 1/20 0.30
▸ MAPK1 P28482 1/20 0.30
▸ CYP2C19 P33261 1/20 0.30
▸ KMT2A Q03164 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
SCHEMBL17337356 0.94 MTNR1A (0.37) MTNR1AMTNR1BCYP1A2ALOX15MAPT
SCHEMBL17337359 0.94 MTNR1A (0.37) MTNR1AMTNR1BCYP1A2ALOX15MAPT
SCHEMBL18966505 0.87 KMT2A (0.40) ALDH1A1MEN1KMT2A
SCHEMBL17337315 0.86 MTNR1A (0.39) MTNR1AMTNR1BALDH1A1MEN1KMT2A
SCHEMBL17337311 0.86 MTNR1A (0.39) MTNR1AMTNR1BALDH1A1MEN1KMT2A
SCHEMBL17337346 0.86 KMT2A (0.36) MTNR1AMTNR1BCYP1A2ALOX15MAPT
SCHEMBL17337345 0.86 KMT2A (0.36) MTNR1AMTNR1BCYP1A2ALOX15MAPT
SCHEMBL23130044 0.85 MTNR1A (0.34) MTNR1AMTNR1BCYP1A2ALOX15MAPT
SCHEMBL22514014 0.85 MTNR1A (0.38) MTNR1AMTNR1BCYP1A2ALOX15MAPT
SCHEMBL17337216 0.85 MTNR1A (0.34) MTNR1AMTNR1B

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-10464952-B2 Beta-lactamase inhibitors VenatoRx Pharmaceuticals, Inc. (US) 2019-11-05 — — US disclosed
US-20180291039-A1 BETA-LACTAMASE INHIBITORS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2018-10-11 — — US disclosed
WO-2017100537-A1 BETA-LACTAMASE INHIBITORS VenatoRx Pharmaceuticals, Inc. (US) 2017-06-15 — — 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 (2 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-10464952-B2 Beta-lactamase inhibitors MGAM, GAA, LCT MTNR1A 3641/4885MTNR1B 3337/4885CYP1A2 510/4885
US-20180291039-A1 BETA-LACTAMASE INHIBITORS MGAM, GAA, LCT MTNR1A 3641/4885MTNR1B 3337/4885CYP1A2 510/4885

“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.

Send feedback