SCHEMBL1482402

SCHEMBL1482402

COc1ccccc1-c1nc2cc(F)c(F)cc2n1CC1CCCCC1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.45
KDM4E B2RXH2 1/20 0.45
HTT P42858 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
NR1H4 Q96RI1 2/20 0.42
PTGER4 P35408 2/20 0.41
ALOX5 P09917 2/20 0.41
CNR2 P34972 2/20 0.39
GHSR Q92847 3/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
HPGD P15428 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HIF1A Q16665 1/20 0.39
CYP11B1 P15538 1/20 0.39
CYP11B2 P19099 1/20 0.39
AGER Q15109 1/20 0.38
RPS6KA2 Q15349 1/20 0.38
MCHR1 Q99705 1/20 0.38
VDR P11473 1/20 0.37

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
SCHEMBL1482662 0.87 NR1H4 (0.51) NR1H4ALOX5CNR2MEN1KMT2A
SCHEMBL1482722 0.85 NR1H4 (0.49) NR1H4PTGER4ALOX5GHSRHPGD
SCHEMBL1482656 0.84 NR1H4 (0.45) LMNAKDM4EHTTNPSR1NR1H4
SCHEMBL1482720 0.84 NR1H4 (0.43) KDM4ENPSR1NR1H4PTGER4ALOX5
SCHEMBL1482406 0.83 NR1H4 (0.48) NR1H4PTGER4CNR2MEN1KMT2A
SCHEMBL1577603 0.82 LMNA (0.39) LMNAKDM4EHTTNPSR1PTGER4
SCHEMBL1483027 0.79 PDE10A (0.39) NR1H4PDE10A
SCHEMBL1482687 0.79 KDM4E (0.52) LMNAKDM4ENPSR1NR1H4ALOX5
SCHEMBL1482027 0.79 NR1H4 (0.43) LMNAKDM4ENPSR1NR1H4PTGER4
SCHEMBL1483031 0.78 FFAR4 (0.41) NR1H4ALOX5CNR2GHSRMEN1

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 LMNA 2064/4885KDM4E 1791/4885HTT 4057/4885

“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.