Cyclohexane

Cyclohexane

SCHEMBL4873977

C1CCCCC1.CCOc1nc(Cl)nc(Nc2ccc(OC)c(Cl)c2)n1

nearest known ligand 0.82

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.82
MEN1 O00255 1/20 0.82
LMNA P02545 1/20 0.82
KMT2A Q03164 1/20 0.82
GAA P10253 1/20 0.63
RECQL P46063 1/20 0.62
NPC1 O15118 1/20 0.55
RAB9A P51151 1/20 0.55
EPHB4 P54760 1/20 0.53
POLB P06746 2/20 0.52
PDE4B Q07343 1/20 0.51
PDE4D Q08499 1/20 0.51
KDM4E B2RXH2 1/20 0.49
NFKB1 P19838 1/20 0.49
BCL6 P41182 3/20 0.47
STK17B O94768 1/20 0.46
STK17A Q9UEE5 1/20 0.46
APP P05067 1/20 0.46
HPGD P15428 1/20 0.44
MAPK1 P28482 1/20 0.43

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
SCHEMBL4836897 0.87 MAPT (0.74) MAPTMEN1LMNAKMT2AGAA
SCHEMBL4836233 0.86 MAPT (0.60) MAPTMEN1LMNAKMT2AGAA
SCHEMBL4838460 0.85 MAPT (0.72) MAPTMEN1LMNAKMT2AGAA
SCHEMBL4873970 0.84 MAPT (0.58) MAPTMEN1LMNAKMT2AGAA
SCHEMBL4829511 0.82 MAPT (0.75) MAPTMEN1LMNAKMT2AGAA
SCHEMBL4832464 0.82 MAPT (0.75) MAPTMEN1LMNAKMT2AGAA
SCHEMBL4832619 0.80 MAPT (0.64) MAPTMEN1LMNAKMT2AGAA
SCHEMBL4873964 0.79 MAPT (0.57) MAPTMEN1LMNAKMT2AGAA
SCHEMBL1391478 0.79 PDE4B (0.81) MAPTMEN1LMNAKMT2ARECQL
SCHEMBL19053363 0.78 MAPT (1.00) MAPTMEN1LMNAKMT2AGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7332489-B2 Methods and compositions of novel triazine compounds REDDY US THERAPEUTICS, INC. (US) 2008-02-19 US disclosed
US-20070099874-A1 Methods and compositions of novel triazine compounds REDDY US THERAPEUTICS, INC. (US) 2007-05-03 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-20070099874-A1 Methods and compositions of novel triazine compounds AREG, TGFB1, PTGIS MAPT 3539/4885MEN1 4761/4885LMNA 2238/4885

“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.