SCHEMBL6700271

SCHEMBL6700271

Cc1ccc(-c2nc(N=C(N)N)nc3ccc(Cl)cc23)cc1F

nearest known ligand 0.65

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.65
KMT2A Q03164 2/20 0.65
RAD52 P43351 1/20 0.65
SLC9A3 P48764 10/20 0.62
MPO P05164 2/20 0.60
KDM4E B2RXH2 1/20 0.54
MEN1 O00255 1/20 0.54
ALDH1A1 P00352 1/20 0.54
HTT P42858 1/20 0.54
NPFFR1 Q9GZQ6 1/20 0.51
NPFFR2 Q9Y5X5 1/20 0.51

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 0.90 KMT2A (0.70) POLBKMT2ARAD52SLC9A3MPO
SCHEMBL6697414 0.88 POLB (0.68) POLBKMT2ARAD52SLC9A3MPO
SCHEMBL6690820 0.85 KMT2A (0.77) POLBKMT2ARAD52SLC9A3MPO
SCHEMBL6695186 0.84 KMT2A (0.77) POLBKMT2ARAD52SLC9A3MPO
SCHEMBL6701162 0.84 KMT2A (0.77) POLBKMT2ARAD52SLC9A3MPO
SCHEMBL27571651 0.84 SLC9A3 (0.63) POLBKMT2ARAD52SLC9A3MPO
SCHEMBL6698138 0.84 POLB (0.63) POLBKMT2ARAD52SLC9A3MPO
SCHEMBL6696132 0.84 KMT2A (0.85) POLBKMT2ARAD52SLC9A3MPO
SCHEMBL6701115 0.82 KMT2A (0.77) POLBKMT2ARAD52SLC9A3MPO
SCHEMBL6695760 0.80 KMT2A (0.97) POLBKMT2ARAD52SLC9A3MPO

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.