SCHEMBL6467089

SCHEMBL6467089

COc1cc(OC)c2nc(Nc3nc(OC(=O)C(F)(F)F)c4cc([N+](=O)[O-])cc(C)c4n3)nc(C)c2c1

nearest known ligand 0.33

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 8/20 0.33
MAPT P10636 6/20 0.33
PKM P14618 1/20 0.33
LMNA P02545 2/20 0.32
MEN1 O00255 5/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
NPSR1 Q6W5P4 2/20 0.31
RXFP1 Q9HBX9 1/20 0.31
ALDH1A1 P00352 4/20 0.31
HTT P42858 2/20 0.31
MAPK1 P28482 1/20 0.31
GAA P10253 1/20 0.30
CRHR1 P34998 1/20 0.30
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30

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
SCHEMBL6470593 0.88 POLB (0.37) KMT2AMAPTPKMLMNAMEN1
SCHEMBL6467957 0.88 STAT3 (0.39) KMT2AMAPTMEN1NPSR1ALDH1A1
SCHEMBL6466111 0.87 ABCG2 (0.41) KMT2AMAPTPKMLMNAMEN1
SCHEMBL6465687 0.86 KMT2A (0.31) KMT2ALMNAMEN1SMN1; SMN2NPSR1
Trifluoroacetic Acid SCHEMBL6467088 0.86 TYMS (0.35) KMT2AMAPTPKMLMNAMEN1
SCHEMBL6470556 0.84 POLB (0.42) KMT2AMAPTMEN1L3MBTL1SMN1; SMN2
SCHEMBL6469779 0.83 KMT2A (0.32) KMT2ALMNAMEN1SMN1; SMN2NPSR1
SCHEMBL6470135 0.80 KMT2A (0.34) KMT2AMAPTLMNAMEN1L3MBTL1
SCHEMBL6470462 0.80 NPSR1 (0.34) KMT2AMAPTLMNAMEN1SMN1; SMN2
SCHEMBL6470356 0.79 POLB (0.33) KMT2AMAPTPKMMEN1SMN1; SMN2

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 3552/4885PKM 3237/4885

“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.