SCHEMBL4182129

SCHEMBL4182129

COc1ccc2nc(-c3ccc(Oc4ccccc4)cc3)[nH]c2c1

nearest known ligand 0.84

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.84
ALDH1A1 P00352 4/20 0.84
SMN1; SMN2 Q16637 4/20 0.84
TP53 P04637 4/20 0.84
HPGD P15428 4/20 0.84
RAB9A P51151 4/20 0.84
KDM4E B2RXH2 3/20 0.84
TSHR P16473 2/20 0.84
NFKB1 P19838 2/20 0.84
NFKB2 Q00653 2/20 0.84
RELA Q04206 2/20 0.84
HSD17B10 Q99714 2/20 0.84
CHEK2 O96017 9/20 0.71
PKM P14618 3/20 0.71
MEN1 O00255 2/20 0.71
POLB P06746 2/20 0.71
KMT2A Q03164 2/20 0.71
LMNA P02545 2/20 0.71
GRIN1 Q05586 1/20 0.63
GRIN2B Q13224 1/20 0.63

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
SCHEMBL4186413 0.92 NPC1 (0.94) NPC1ALDH1A1SMN1; SMN2TP53HPGD
SCHEMBL20445328 0.91 NPC1 (1.00) NPC1ALDH1A1SMN1; SMN2TP53HPGD
SCHEMBL20982659 0.90 NPC1 (0.85) NPC1ALDH1A1SMN1; SMN2TP53HPGD
SCHEMBL5634840 0.84 NPC1 (0.91) NPC1ALDH1A1SMN1; SMN2TP53HPGD
SCHEMBL4188790 0.83 CHEK2 (0.71) NPC1ALDH1A1SMN1; SMN2TP53HPGD
SCHEMBL4188962 0.83 MEN1 (0.76) NPC1ALDH1A1SMN1; SMN2TP53HPGD
SCHEMBL13015025 0.83 NPC1 (0.88) NPC1ALDH1A1SMN1; SMN2TP53HPGD
SCHEMBL6243395 0.83 NPC1 (1.00) NPC1ALDH1A1SMN1; SMN2TP53HPGD
SCHEMBL4182601 0.83 CHEK2 (0.67) NPC1ALDH1A1SMN1; SMN2TP53HPGD
SCHEMBL2318983 0.83 CHEK2 (0.73) NPC1ALDH1A1SMN1; SMN2TP53HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1861387-B1 BENZIMIDAZOLE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS THEREOF DAE WOONG PHARMA (KR) 2014-04-16 EP claimed
US-20090018124-A1 Novel Benzoimidazole Derivatives and Pharmaceutical Composition Comprising the Same DAEWOONG PHARMACEUTICAL CO., LTD. (KR) 2009-01-15 US claimed
EP-1861387-A1 NOVEL BENZOIMIDAZOLE DERIVATIVES AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME DAEWOONG PHARMACEUTICAL CO., LTD. (KR) 2007-12-05 EP claimed
WO-2006080821-A1 NOVEL BENZOIMIDAZOLE DERIVATIVES AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME DAEWOONG PHARMACEUTICAL CO., LTD. (KR) 2006-08-03 WO claimed
US-9199965-B2 Benzoimidazole derivatives and pharmaceutical composition comprising the same DAEWOONG CO., LTD. (KR) 2015-12-01 US disclosed
US-9199965-B2 Benzoimidazole derivatives and pharmaceutical composition comprising the same DAEWOONG CO., LTD. (KR) 2015-12-01 US disclosed
US-9199965-B2 Benzoimidazole derivatives and pharmaceutical composition comprising the same DAEWOONG CO., LTD. (KR) 2015-12-01 US disclosed
EP-1861387-B1 BENZIMIDAZOLE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS THEREOF DAE WOONG PHARMA (KR) 2014-04-16 EP disclosed
EP-1861387-B1 BENZIMIDAZOLE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS THEREOF DAE WOONG PHARMA (KR) 2014-04-16 EP disclosed
US-20090018124-A1 Novel Benzoimidazole Derivatives and Pharmaceutical Composition Comprising the Same DAEWOONG PHARMACEUTICAL CO., LTD. (KR) 2009-01-15 US disclosed
US-20090018124-A1 Novel Benzoimidazole Derivatives and Pharmaceutical Composition Comprising the Same DAEWOONG PHARMACEUTICAL CO., LTD. (KR) 2009-01-15 US disclosed
US-20090018124-A1 Novel Benzoimidazole Derivatives and Pharmaceutical Composition Comprising the Same DAEWOONG PHARMACEUTICAL CO., LTD. (KR) 2009-01-15 US disclosed
EP-1861387-A1 NOVEL BENZOIMIDAZOLE DERIVATIVES AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME DAEWOONG PHARMACEUTICAL CO., LTD. (KR) 2007-12-05 EP disclosed
WO-2006080821-A1 NOVEL BENZOIMIDAZOLE DERIVATIVES AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME DAEWOONG PHARMACEUTICAL CO., LTD. (KR) 2006-08-03 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-20090018124-A1 Novel Benzoimidazole Derivatives and Pharmaceutical Composition Comprising the Same TRPV1, TRPA1, BDKRB2 NPC1 1781/4885ALDH1A1 1281/4885SMN1; SMN2 1331/4885

“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.