SCHEMBL6469759

SCHEMBL6469759

COc1cc2c(C)nc(Nc3nc(OC(=O)C(F)(F)F)c4c(OC)cccc4n3)nc2cc1F

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.37
MAPT P10636 7/20 0.37
TP53 P04637 5/20 0.37
POLB P06746 1/20 0.37
MEN1 O00255 3/20 0.37
RAD52 P43351 2/20 0.37
ABCG2 Q9UNQ0 1/20 0.36
SMN1; SMN2 Q16637 3/20 0.35
NPSR1 Q6W5P4 1/20 0.35
ALDH1A1 P00352 3/20 0.34
ELANE P08246 2/20 0.34
KDM4E B2RXH2 1/20 0.34
RAB9A P51151 3/20 0.33
NPC1 O15118 1/20 0.33
MAPK1 P28482 1/20 0.33
GRM4 Q14833 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
SCHEMBL6470336 0.94 ABCG2 (0.42) KMT2AMAPTTP53POLBMEN1
SCHEMBL6467879 0.89 KMT2A (0.45) KMT2AMAPTTP53POLBMEN1
SCHEMBL6466280 0.88 KMT2A (0.37) KMT2AMAPTTP53POLBMEN1
SCHEMBL6470579 0.87 TDP2 (0.44) KMT2AMAPTTP53POLBMEN1
SCHEMBL6467196 0.87 ABCG2 (0.38) KMT2AMAPTTP53POLBMEN1
Trifluoroacetic Acid SCHEMBL6469755 0.84 KMT2A (0.40) KMT2AMAPTTP53POLBMEN1
SCHEMBL6467078 0.84 KMT2A (0.36) KMT2AMAPTTP53POLBMEN1
SCHEMBL6467334 0.84 ABCG2 (0.39) KMT2AMAPTTP53POLBMEN1
SCHEMBL6467851 0.83 MAPT (0.36) KMT2AMAPTTP53POLBMEN1
SCHEMBL6469501 0.82 ABCG2 (0.38) KMT2AMAPTTP53POLBMEN1

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 KMT2A 2156/4885MAPT 3552/4885TP53 1339/4885

“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.