SCHEMBL1482444

SCHEMBL1482444

N#Cc1ccc(COc2cc(Cl)ccc2-c2nc3cc(F)c(F)cc3n2CC2CCCCC2)cc1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 2/20 0.45
ALOX5 P09917 2/20 0.41
CNR2 P34972 5/20 0.39
CTSL P07711 1/20 0.39
CTSS P25774 1/20 0.39
CTSK P43235 1/20 0.39
GLP1R P43220 4/20 0.36
VDR P11473 1/20 0.36
HTR2A P28223 2/20 0.36
HTR2C P28335 2/20 0.36
SLC6A4 P31645 2/20 0.36
KCNH2 Q12809 1/20 0.35
TDP2 O95551 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL1482661 0.92 NR1H4 (0.44) NR1H4ALOX5CNR2CTSLCTSS
SCHEMBL1482797 0.91 MRGPRX4 (0.43) NR1H4ALOX5CNR2CTSLCTSS
SCHEMBL1482050 0.90 NR1H4 (0.44) NR1H4ALOX5CTSLCTSSCTSK
SCHEMBL1482691 0.90 NR1H4 (0.44) NR1H4ALOX5CNR2CTSLCTSS
SCHEMBL1482276 0.89 NR1H4 (0.43) NR1H4ALOX5GLP1RVDRHTR2A
SCHEMBL1482770 0.88 KCNH2 (0.41) NR1H4SLC6A4KCNH2
SCHEMBL1482189 0.88 NR1H4 (0.42) NR1H4ALOX5CNR2CTSLCTSS
SCHEMBL1482669 0.87 NR1H4 (0.41) NR1H4ALOX5CNR2CTSLCTSS
SCHEMBL1483039 0.86 NR1H4 (0.49) NR1H4ALOX5CNR2VDRKCNH2
SCHEMBL1483014 0.86 NR1H4 (0.51) NR1H4ALOX5GLP1RVDRKCNH2

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 NR1H4 776/4885ALOX5 3919/4885CNR2 1192/4885

“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.