SCHEMBL257248

SCHEMBL257248

Bc1ccc(C(=O)O)nc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P4HTM Q9NXG6 15/20 0.59
P4HA1 P13674 1/20 0.59
MIF P14174 1/20 0.59
KDM4E B2RXH2 4/20 0.57
ALDH1A1 P00352 2/20 0.57
L3MBTL1 Q9Y468 4/20 0.48
MAPK1 P28482 1/20 0.48
KMT2A Q03164 2/20 0.46
HIF1A Q16665 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
LMNA P02545 2/20 0.46
GLA P06280 1/20 0.46
HTT P42858 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
MEN1 O00255 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
MAPT P10636 1/20 0.46
PKM P14618 1/20 0.46
ALOX15 P16050 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
SCHEMBL12030771 0.80 P4HTM (0.38) P4HTMP4HA1MIFKDM4EALDH1A1
SCHEMBL14149227 0.80 ALDH1A1 (0.47) P4HTMP4HA1MIFKDM4EALDH1A1
SCHEMBL21711191 0.80 P4HTM (0.42) P4HTMP4HA1MIFKDM4EALDH1A1
SCHEMBL13731115 0.76 P4HTM (0.64) P4HTMP4HA1MIFKDM4EALDH1A1
SCHEMBL8115587 0.75 MAPK1 (0.65) KDM4EALDH1A1L3MBTL1MAPK1KMT2A
SCHEMBL14069483 0.75 KDM4E (0.38) P4HTMP4HA1MIFKDM4EALDH1A1
SCHEMBL2669393 0.75 PIK3CD (0.43) P4HTMP4HA1MIFKDM4EALDH1A1
SCHEMBL15739564 0.75 PIP5K1C (0.43) KDM4EALDH1A1MAPK1LMNACYP1A2
Pyridine-2,5-Dicarboxylic Acid SCHEMBL29363410 0.74 P4HTM (1.00) P4HTMP4HA1MIFKDM4EALDH1A1
Pyridine-2,5-Dicarboxylic Acid SCHEMBL70231 0.74 P4HTM (1.00) P4HTMP4HA1MIFKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111714641-B 5-boron pyridine carboxylic acid modified targeted drug delivery system and preparation method thereof 内蒙古民族大学 2023-01-24 CN disclosed
WO-2016124304-A1 METAL COMPLEXES MERCK PATENT GMBH (DE) 2016-08-11 WO disclosed
EP-1954287-B2 CETP INHIBITORS MERCK SHARP & DOHME (US) 2016-02-24 EP disclosed
US-8334290-B2 CETP inhibitors MERCK SHARP & DOHME CORP. (US) 2012-12-18 US disclosed
US-8334290-B2 CETP inhibitors MERCK SHARP & DOHME CORP. (US) 2012-12-18 US disclosed
WO-2012029942-A1 CYCLIC AMIDE DERIVATIVE 大日本住友製薬株式会社 (JP) 2012-03-08 WO disclosed
EP-1954287-B1 CETP INHIBITORS MERCK SHARP & DOHME (US) 2011-11-16 EP disclosed
US-20090264405-A1 Cetp Inhibitors MERCK SHARP & DOHME LLC 2009-10-22 US disclosed
US-20090264405-A1 Cetp Inhibitors MERCK SHARP & DOHME LLC 2009-10-22 US disclosed
WO-2008125945-A2 3-AMIDO-PYRROLO [3, 4-C] PYRAZOLE-5 (1H, 4H, 6H) CARBALDEHYDE DERIVATIVES AS INHIBITORS OF PROTEIN KINASE C PFIZER INC. (US) 2008-10-23 WO disclosed
WO-2007070173-A2 CETP INHIBITORS MERCK & CO., INC. (US) 2007-06-21 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 (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-20090264405-A1 Cetp Inhibitors CETP, APOB, PCSK9 P4HTM 3654/4885P4HA1 1574/4885MIF 2135/4885

“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.