SCHEMBL6469779

SCHEMBL6469779

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

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.32
MEN1 O00255 2/20 0.32
CYP1A2 P05177 2/20 0.32
CYP3A4 P08684 2/20 0.32
GAA P10253 2/20 0.32
CYP2D6 P10635 2/20 0.32
CYP2C19 P33261 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
LMNA P02545 1/20 0.32
POLB P06746 1/20 0.32
RAD52 P43351 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
PIK3CA P42336 1/20 0.32
JAK2 O60674 1/20 0.32
KDM4E B2RXH2 1/20 0.31

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
SCHEMBL6465687 0.95 KMT2A (0.31) KMT2AMEN1CYP1A2CYP3A4GAA
SCHEMBL6467461 0.90 KDM4E (0.44) KMT2AMEN1SMN1; SMN2LMNAPOLB
SCHEMBL6467957 0.88 STAT3 (0.39) KMT2AMEN1CYP1A2CYP3A4GAA
SCHEMBL6470556 0.85 POLB (0.42) KMT2AMEN1GAASMN1; SMN2POLB
SCHEMBL6470462 0.85 NPSR1 (0.34) KMT2AMEN1CYP1A2CYP3A4GAA
SCHEMBL6470356 0.84 POLB (0.33) KMT2AMEN1GAASMN1; SMN2POLB
Trifluoroacetic Acid SCHEMBL6469776 0.84 KMT2A (0.35) KMT2AMEN1CYP1A2CYP3A4GAA
SCHEMBL6467078 0.84 KMT2A (0.36) KMT2AMEN1SMN1; SMN2POLBNPSR1
SCHEMBL6467089 0.83 KMT2A (0.33) KMT2AMEN1GAASMN1; SMN2LMNA
SCHEMBL6468652 0.82 MAPT (0.36) KMT2AMEN1CYP1A2CYP3A4GAA

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 2156/4885MEN1 4218/4885CYP1A2 1224/4885

“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.