SCHEMBL6862314

SCHEMBL6862314

CCCCNc1nc(N(CCC)c2ccc(OC)c(Cl)c2)nc(N(C)C2CCNCC2)n1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 3/20 0.39
RCOR1 Q9UKL0 3/20 0.39
EHMT2 Q96KQ7 3/20 0.39
GBA1 P04062 2/20 0.36
TLR7 Q9NYK1 5/20 0.33
CYP3A4 P08684 2/20 0.33
CYP2C9 P11712 1/20 0.33
BCL6 P41182 2/20 0.33
EHMT1 Q9H9B1 1/20 0.33
KMT5A Q9NQR1 2/20 0.33
KCNH2 Q12809 2/20 0.33
CYP2C8 P10632 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C19 P33261 1/20 0.33
TRIM58 Q8NG06 1/20 0.33
QPCT Q16769 1/20 0.32
NMT1 P30419 1/20 0.32
FLT3 P36888 1/20 0.32
TYRO3 Q06418 1/20 0.32
MERTK Q12866 1/20 0.32

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
SCHEMBL6645858 0.81 BCL6 (0.44) KDM1ARCOR1EHMT2GBA1BCL6
SCHEMBL4836313 0.77 MAPT (0.43) EHMT2BCL6EHMT1
SCHEMBL4836660 0.75 BCL6 (0.53) KDM1ARCOR1EHMT2BCL6EHMT1
SCHEMBL4838558 0.67 BCL6 (0.49) EHMT2BCL6EHMT1
SCHEMBL4829068 0.67 BCL6 (0.46) EHMT2GBA1BCL6EHMT1
SCHEMBL4832263 0.67 SLC2A1 (0.37) EHMT2TLR7BCL6EHMT1KMT5A
SCHEMBL4836307 0.67 EHMT2 (0.47) EHMT2BCL6EHMT1
SCHEMBL4838011 0.66 BCL6 (0.55) EHMT2BCL6EHMT1
SCHEMBL14421530 0.66 BCL6 (0.40) KDM1ARCOR1EHMT2GBA1BCL6
SCHEMBL14454103 0.66 BCL6 (0.46) EHMT2BCL6EHMT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040077648-A1 Methods and compositions of novel triazine compounds DR. REDDY'S LABORATORIES LTD. (IN) 2004-04-22 US claimed

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-20040077648-A1 Methods and compositions of novel triazine compounds AREG, TGFB1, PTGIS KDM1A 3351/4885RCOR1 2992/4885EHMT2 2905/4885

“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.