SCHEMBL2345296

SCHEMBL2345296

O=C(Nc1ccc2cc[nH]c2c1)c1ccc(-c2cccc(C(=O)Nc3ccc(N4CCOCC4)cc3)c2)cc1

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 1/20 0.55
MAPT P10636 6/20 0.54
RAB9A P51151 3/20 0.54
SMN1; SMN2 Q16637 3/20 0.54
HTT P42858 1/20 0.54
ROCK1 Q13464 2/20 0.54
HDAC8 Q9BY41 1/20 0.54
HDAC6 Q9UBN7 1/20 0.54
ESR1 P03372 5/20 0.53
NPC1 O15118 2/20 0.53
ATM Q13315 1/20 0.53
TP53 P04637 1/20 0.53
PKM P14618 1/20 0.53
MAPK1 P28482 1/20 0.53
LMNA P02545 1/20 0.51
ALDH1A1 P00352 1/20 0.51
GAA P10253 1/20 0.51
KMT2A Q03164 1/20 0.51
KDM4E B2RXH2 1/20 0.50

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
SCHEMBL2343443 0.93 MAPT (0.56) MAPK14MAPTRAB9ASMN1; SMN2HTT
SCHEMBL2350685 0.86 MAPK14 (0.66) MAPK14MAPTRAB9AROCK1HDAC8
SCHEMBL2344276 0.84 MAPK14 (0.63) MAPK14MAPTRAB9AROCK1ESR1
SCHEMBL2346130 0.84 MAPT (0.62) MAPTRAB9ASMN1; SMN2HTTROCK1
SCHEMBL14028046 0.81 RAB9A (0.72) MAPTRAB9ASMN1; SMN2HTTHDAC8
SCHEMBL1663772 0.81 HDAC8 (0.59) MAPTRAB9ASMN1; SMN2HTTROCK1
SCHEMBL2349122 0.80 MAPK14 (0.62) MAPK14MAPTRAB9AROCK1HDAC8
SCHEMBL6165669 0.78 ESR1 (0.60) MAPK14MAPTRAB9ASMN1; SMN2HTT
SCHEMBL2351047 0.78 MAPT (0.65) MAPTRAB9ASMN1; SMN2HTTNPC1
SCHEMBL1663768 0.77 HDAC8 (0.54) MAPTRAB9ASMN1; SMN2HTTROCK1

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-8008303-B2 e.g. 6-Methyl-biphenyl-3,4'-dicarboxylic acid 4'-[(3-bromo-phenyl)-amide]-[(4 morpholin-4-yl-phenyl)-amide]; viricide; with other active viricide such as interferon or ribavirin ASTRAZENECA AB (SE) 2011-08-30 US disclosed
US-20080255105-A1 Biphenyl Derivatives and Their Use in Treating Hepatitis C ARROW THERAPEUTICS LIMITED (GB) 2008-10-16 US disclosed
EP-1940786-A1 BIPHENYL DERIVATIVES AND THEIR USE IN TREATING HEPATITIS C Arrow Therapeutics Limited (GB) 2008-07-09 EP disclosed
WO-2007031791-A1 BIPHENYL DERIVATIVES AND THEIR USE IN TREATING HEPATITIS C ARROW THERAPEUTICS LIMITED (GB) 2007-03-22 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-20080255105-A1 Biphenyl Derivatives and Their Use in Treating Hepatitis C NR4A1, NR0B1, NR1H4 MAPK14 4315/4885MAPT 4798/4885RAB9A 1870/4885

“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.