SCHEMBL6469602

SCHEMBL6469602

COc1cc2nc(Nc3nc(OC(=O)C(F)(F)F)c4cc(N)cc(C)c4n3)nc(C)c2cc1OC

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.38
TP53 P04637 7/20 0.38
RAD52 P43351 4/20 0.38
POLB P06746 4/20 0.38
MEN1 O00255 4/20 0.38
KMT2A Q03164 4/20 0.38
BLM P54132 2/20 0.36
MITF O75030 1/20 0.36
ABCG2 Q9UNQ0 2/20 0.36
UBE2N P61088 1/20 0.36
SLC2A1 P11166 1/20 0.35
KRAS P01116 1/20 0.34
SOS1 Q07889 1/20 0.34
WHR1 P49842 2/20 0.33
EHMT2 Q96KQ7 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33

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
SCHEMBL6469547 0.91 MAPT (0.38) MAPTTP53RAD52POLBMEN1
SCHEMBL6470555 0.88 KDM4E (0.44) MAPTTP53POLBMEN1KMT2A
SCHEMBL6468688 0.88 KDM1A (0.36) MAPTTP53RAD52POLBMEN1
SCHEMBL6465687 0.86 KMT2A (0.31) TP53RAD52POLBMEN1KMT2A
SCHEMBL6466111 0.86 ABCG2 (0.41) MAPTTP53RAD52POLBMEN1
SCHEMBL6467851 0.85 MAPT (0.36) MAPTTP53RAD52POLBMEN1
Trifluoroacetic Acid SCHEMBL6469598 0.84 MAPT (0.41) MAPTTP53RAD52POLBMEN1
SCHEMBL6467461 0.83 KDM4E (0.44) MAPTTP53POLBMEN1KMT2A
SCHEMBL6469501 0.82 ABCG2 (0.38) MAPTTP53RAD52POLBMEN1
SCHEMBL6467193 0.82 ABCG2 (0.40) MAPTTP53RAD52POLBMEN1

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-20050124562-A1 Bis-quinazoline compounds for the treatment of bacterial infections REPLIDYNE, INC. 2005-06-09 US claimed
WO-2005030131-A2 BIS-QUINAZOLINE COMPOUNDS FOR THE TREATMENT OF BACTERIAL INFECTIONS REPLIDYNE, INC (US) 2005-04-07 WO claimed
US-20050124562-A1 Bis-quinazoline compounds for the treatment of bacterial infections REPLIDYNE, INC. 2005-06-09 US disclosed
WO-2005030131-A2 BIS-QUINAZOLINE COMPOUNDS FOR THE TREATMENT OF BACTERIAL INFECTIONS REPLIDYNE, INC (US) 2005-04-07 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-20050124562-A1 Bis-quinazoline compounds for the treatment of bacterial infections POLI, POLK, POLB MAPT 3552/4885TP53 1339/4885RAD52 234/4885

“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.