SCHEMBL6707726

SCHEMBL6707726

N#Cc1ccc(NC(=O)c2cc3cccc(NC(=O)c4ccno4)c3[nH]2)c(-c2nnn[nH]2)c1

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.36
PKM P14618 1/20 0.35
RXFP1 Q9HBX9 3/20 0.35
TP53 P04637 3/20 0.35
POLB P06746 2/20 0.35
MAPT P10636 2/20 0.35
RXFP2 Q8WXD0 1/20 0.35
HDAC1 Q13547 1/20 0.35
THRB P10828 1/20 0.33
CSF1R P07333 1/20 0.33
MAP3K5 Q99683 1/20 0.32
LMNA P02545 1/20 0.32
HTT P42858 1/20 0.32
MEN1 O00255 1/20 0.31
MAPK1 P28482 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
SCHEMBL6710408 0.88 KMT2A (0.37) KMT2ARXFP1TP53POLBMAPT
SCHEMBL6711675 0.88 KMT2A (0.38) KMT2ARXFP1TP53POLBMAPT
SCHEMBL6710380 0.87 MAP3K5 (0.43) KMT2APKMRXFP1TP53POLB
SCHEMBL6710250 0.87 KMT2A (0.42) KMT2ARXFP1TP53HDAC1MEN1
SCHEMBL6714056 0.86 KMT2A (0.36) KMT2APKMRXFP1TP53POLB
SCHEMBL6709018 0.86 PKM (0.35) PKMRXFP1TP53POLBMAPT
SCHEMBL6709197 0.86 IRAK4 (0.42) KMT2ARXFP1HDAC1MEN1
SCHEMBL6710254 0.86 NPC1 (0.40) LMNA
SCHEMBL6713373 0.85 RXFP1 (0.40) KMT2APKMRXFP1TP53POLB
SCHEMBL6713312 0.85 TDP1 (0.38) KMT2ARXFP1HDAC1MEN1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040142981-A1 Antibacterial benzoic acid derivatives PHARMACIA & UPJOHN COMPANY 2004-07-22 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-20040142981-A1 Antibacterial benzoic acid derivatives GABRD, PHB1, GABBR1 KMT2A 3181/4885PKM 3958/4885RXFP1 3836/4885

“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.