SCHEMBL5329533

SCHEMBL5329533

CNC(=O)c1cn2c(C)c(C)nc2c(O)c1CCC(=O)c1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.36
CYP2D6 P10635 2/20 0.36
CYP2C9 P11712 2/20 0.36
GLA P06280 1/20 0.35
KDM4E B2RXH2 2/20 0.35
POLB P06746 1/20 0.35
PTGDR2 Q9Y5Y4 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2C19 P33261 1/20 0.34
HPGD P15428 3/20 0.34
ALDH1A1 P00352 2/20 0.34
NPSR1 Q6W5P4 1/20 0.34
LMNA P02545 4/20 0.34
TP53 P04637 4/20 0.34
HSD11B1 P28845 2/20 0.34
MAPT P10636 3/20 0.33
PDE10A Q9Y233 1/20 0.33
MEN1 O00255 1/20 0.33
HTT P42858 1/20 0.33
KMT2A Q03164 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
SCHEMBL5327618 0.89 GLA (0.38) CYP3A4CYP2D6CYP2C9GLAKDM4E
Bicarbonate SCHEMBL5984921 0.88 GLA (0.37) CYP3A4CYP2D6CYP2C9GLAKDM4E
SCHEMBL5328503 0.87 ADRA1D (0.40) CYP3A4CYP2D6CYP2C9TP53KMT2A
SCHEMBL5559185 0.86 KMT2A (0.42) KDM4EPOLBCYP1A2CYP2C19HPGD
SCHEMBL4994479 0.85 KMT2A (0.36) CYP3A4CYP2D6CYP2C9GLACYP1A2
SCHEMBL5330704 0.84 SMN1; SMN2 (0.43) CYP2C9KDM4ECYP1A2CYP2C19HPGD
Bicarbonate SCHEMBL4976269 0.84 KMT2A (0.35) CYP3A4CYP2D6CYP2C9GLACYP1A2
Formic Acid SCHEMBL4976263 0.82 HSD11B1 (0.34) CYP3A4CYP2D6CYP2C9GLACYP1A2
SCHEMBL5569978 0.82 LMNA (0.38) CYP3A4CYP2D6CYP2C9KDM4EPOLB
SCHEMBL5569980 0.82 LMNA (0.38) CYP3A4CYP2D6CYP2C9KDM4EPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007141253-A1 PROCESS FOR THE PRODUCTION OF INTERMEDIATES FOR THE PREPARATION OF TRICYCLIC IMIDAZOPYRIDINES NYCOMED GMBH (DE) 2007-12-13 WO disclosed
US-20070066674-A1 Tricyclic imidzopyridines for use as gastric secretion inhibitors ALTANA PHARMA AG (DE) 2007-03-22 US disclosed
EP-1696921-A1 TRICYCLIC IMIDAZOPYRIDINES FOR USE AS GASTRIC SECRETION INHIBITORS Altana Pharma AG (DE) 2006-09-06 EP disclosed
WO-2005058325-A1 TRICYCLIC IMIDAZOPYRIDINES FOR USE AS GASTRIC SECRETION INHIBITORS ALTANA PHARMA AG (DE) 2005-06-30 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-20070066674-A1 Tricyclic imidzopyridines for use as gastric secretion inhibitors GIPR, SLC10A2, GRPR CYP3A4 72/4885CYP2D6 100/4885CYP2C9 110/4885

“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.