SCHEMBL1483027

SCHEMBL1483027

N#Cc1ccc(COc2ccccc2-c2nc3cc(F)c(F)cc3n2CC2CCCCC2)c(F)c1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 2/20 0.39
GLP1R P43220 14/20 0.38
HTR2A P28223 2/20 0.37
HTR2C P28335 2/20 0.37
SLC6A4 P31645 2/20 0.37
PTGER1 P34995 1/20 0.37
HTR1A P08908 1/20 0.37
CYP2C8 P10632 1/20 0.37
KCNH2 Q12809 1/20 0.37
NR1H4 Q96RI1 1/20 0.36

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
SCHEMBL1481990 0.90 HTR2A (0.37) PDE10AGLP1RHTR2AHTR2CSLC6A4
SCHEMBL1482050 0.90 NR1H4 (0.44) PDE10AGLP1RHTR2AHTR2CSLC6A4
SCHEMBL1482276 0.89 NR1H4 (0.43) PDE10AGLP1RHTR2AHTR2CSLC6A4
SCHEMBL1482995 0.86 KCNN4 (0.37) PDE10AGLP1RHTR1ACYP2C8KCNH2
SCHEMBL1482337 0.84 GLP1R (0.40) PDE10AGLP1RHTR2AHTR2CSLC6A4
SCHEMBL1482189 0.82 NR1H4 (0.42) GLP1RHTR2AHTR2CSLC6A4NR1H4
SCHEMBL1482279 0.82 GLP1R (0.42) PDE10AGLP1RHTR1ACYP2C8KCNH2
SCHEMBL1482694 0.82 NR1H4 (0.37) PDE10AGLP1RHTR2AHTR2CSLC6A4
SCHEMBL1482669 0.81 NR1H4 (0.41) GLP1RHTR2AHTR2CSLC6A4NR1H4
SCHEMBL1482292 0.81 NR1H4 (0.42) GLP1RHTR2AHTR2CSLC6A4PTGER1

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
US-8309581-B2 Benzimidazole derivatives HOFFMANN-LA ROCHE INC. (US) 2012-11-13 US disclosed
EP-2483247-A1 NEW BENZIMIDAZOLE DERIVATIVES AND THEIR USE AS FXR AGONISTS F. Hoffmann-La Roche AG (CH) 2012-08-08 EP disclosed
WO-2011039130-A1 NEW BENZIMIDAZOLE DERIVATIVES AND THEIR USE AS FXR AGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2011-04-07 WO disclosed
US-20110077273-A1 NEW BENZIMIDAZOLE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2011-03-31 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 (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-20110077273-A1 NEW BENZIMIDAZOLE DERIVATIVES BRI3BP, CYP3A4, RB1 PDE10A 780/4885GLP1R 451/4885HTR2A 2136/4885

“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.