SCHEMBL6697414

SCHEMBL6697414

Cc1ccc(-c2nc(N=C(N)N)nc3ccc(Cl)cc23)cc1Cl

nearest known ligand 0.68

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.68
KMT2A Q03164 2/20 0.68
RAD52 P43351 1/20 0.68
MPO P05164 2/20 0.63
SLC9A3 P48764 8/20 0.56
NPFFR1 Q9GZQ6 1/20 0.53
NPFFR2 Q9Y5X5 1/20 0.53
KDM4E B2RXH2 1/20 0.50
MEN1 O00255 1/20 0.50
ALDH1A1 P00352 1/20 0.50
HTT P42858 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
SCHEMBL6692445 0.92 KMT2A (0.70) POLBKMT2ARAD52MPOSLC9A3
SCHEMBL6700271 0.88 POLB (0.65) POLBKMT2ARAD52MPOSLC9A3
SCHEMBL6695186 0.86 KMT2A (0.77) POLBKMT2ARAD52MPOSLC9A3
SCHEMBL6696132 0.86 KMT2A (0.85) POLBKMT2ARAD52MPOSLC9A3
SCHEMBL6695605 0.84 KMT2A (0.73) POLBKMT2ARAD52MPOSLC9A3
SCHEMBL27578974 0.84 POLB (0.65) POLBKMT2ARAD52MPOSLC9A3
SCHEMBL6695760 0.82 KMT2A (0.97) POLBKMT2ARAD52MPOSLC9A3
SCHEMBL6701115 0.81 KMT2A (0.77) POLBKMT2ARAD52MPOSLC9A3
SCHEMBL6701162 0.81 KMT2A (0.77) POLBKMT2ARAD52MPOSLC9A3
SCHEMBL6700380 0.81 KMT2A (0.72) POLBKMT2ARAD52MPOSLC9A3

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-20040224965-A1 2-Guanidino-4-arylchinazolines as nhe-3 inhibitors MERCK PATENT GMBH (DE) 2004-11-11 US claimed
US-20040224965-A1 2-Guanidino-4-arylchinazolines as nhe-3 inhibitors MERCK PATENT GMBH (DE) 2004-11-11 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-20040224965-A1 2-Guanidino-4-arylchinazolines as nhe-3 inhibitors NHERF1, SLC9A3, SLC9A1 POLB 4015/4885KMT2A 3326/4885RAD52 4856/4885

“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.