SCHEMBL1728476

SCHEMBL1728476

CC1(C)OB(c2ccc3nc(C(=O)c4ccccc4)cn3c2)OC1(C)C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P4HB P07237 1/20 0.44
LPL P06858 2/20 0.40
LIPG Q9Y5X9 2/20 0.40
PTGS1 P23219 1/20 0.38
PTGS2 P35354 1/20 0.38
CYP2C9 P11712 1/20 0.38
NR4A2 P43354 1/20 0.38
F2 P00734 1/20 0.36
F11 P03951 1/20 0.36
PRSS1 P07477 1/20 0.36
PRSS2 P07478 1/20 0.36
PRSS3 P35030 1/20 0.36
EGLN1 Q9GZT9 1/20 0.36
KMT2A Q03164 1/20 0.35
KDM4E B2RXH2 1/20 0.35
NPC1 O15118 1/20 0.35
ALDH1A1 P00352 1/20 0.35
POLB P06746 1/20 0.35
HPGD P15428 1/20 0.35
NFKB1 P19838 1/20 0.35

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
SCHEMBL1734165 0.86 PTGS1 (0.46) P4HBLPLLIPGPTGS1PTGS2
SCHEMBL3770025 0.83 NPC1 (0.56) CYP2C9NR4A2EGLN1KDM4ENPC1
Bromide SCHEMBL3766943 0.82 NPC1 (0.55) CYP2C9NR4A2EGLN1KDM4ENPC1
SCHEMBL21033489 0.79 KDM4E (0.54) KMT2AKDM4ENPC1ALDH1A1POLB
Bromide SCHEMBL1735154 0.78 KDM4E (0.53) KMT2AKDM4ENPC1ALDH1A1POLB
SCHEMBL2085892 0.76 RAB9A (0.50) PTGS1PTGS2EGLN1KMT2AKDM4E
SCHEMBL26907652 0.76 MAP3K5 (0.42) P4HBLPLLIPGF2F11
Hydrochloric Acid SCHEMBL2086035 0.75 RAB9A (0.49) PTGS1PTGS2EGLN1KMT2AKDM4E
SCHEMBL1128765 0.75 P4HB (0.50) P4HBLPLLIPGF2F11
SCHEMBL5800648 0.74 P4HB (0.62) P4HBLPLLIPGF2F11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2260033-B1 2-benzoylimidazo[1,2-a]pyridine derivatives, preparation thereof and therapeutic use thereof SANOFI SA (FR) 2011-11-23 EP claimed
US-20100317687-A1 2-BENZOYLIMIDAZO[1,2-a]PYRIDINE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2010-12-16 US claimed
EP-2260033-B1 2-benzoylimidazo[1,2-a]pyridine derivatives, preparation thereof and therapeutic use thereof SANOFI SA (FR) 2011-11-23 EP disclosed
US-20100317687-A1 2-BENZOYLIMIDAZO[1,2-a]PYRIDINE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2010-12-16 US disclosed
EP-2260033-A1 2-BENZOYLIMIDAZO[1,2-A]PYRIDINE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF Sanofi-Aventis (FR) 2010-12-15 EP disclosed
WO-2009112652-A1 2-BENZOYLIMIDAZO[1,2-A]PYRIDINE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2009-09-17 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-20100317687-A1 2-BENZOYLIMIDAZO[1,2-a]PYRIDINE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF XDH, REN, GLS P4HB 1236/4885LPL 4650/4885LIPG 4625/4885

“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.