SCHEMBL6707664

SCHEMBL6707664

Cc1ccccc1CC(=O)Nc1cccc2cc(C(=O)Nc3ccc(Br)cc3-c3noc(=O)[nH]3)[nH]c12

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NSD2 O96028 1/20 0.41
ALDH1A1 P00352 1/20 0.40
NPC1 O15118 1/20 0.39
PLA2G7 Q13093 3/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
HDAC3 O15379 1/20 0.38
HDAC1 Q13547 1/20 0.38
GRIK1 P39086 1/20 0.37
PARP14 Q460N5 1/20 0.36
POLB P06746 2/20 0.35
DHODH Q02127 1/20 0.35
LMNA P02545 1/20 0.34
TP53 P04637 1/20 0.34
MAPT P10636 1/20 0.34

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
SCHEMBL6712548 0.92 KMT2A (0.48) ALDH1A1PLA2G7MEN1KMT2AHDAC3
SCHEMBL6707838 0.91 CSNK1D (0.44) ALDH1A1PLA2G7MEN1KMT2AHDAC3
SCHEMBL6710031 0.91 NSD2 (0.41) NSD2ALDH1A1NPC1PLA2G7MEN1
SCHEMBL6709037 0.91 PARP14 (0.42) ALDH1A1PLA2G7MEN1KMT2AGRIK1
SCHEMBL6710051 0.89 MEN1 (0.40) NSD2ALDH1A1MEN1KMT2AHDAC3
SCHEMBL6708561 0.89 NSD2 (0.39) NSD2ALDH1A1NPC1PLA2G7MEN1
SCHEMBL6708826 0.89 PLA2G7 (0.39) ALDH1A1NPC1PLA2G7MEN1KMT2A
SCHEMBL6711425 0.88 PARP14 (0.40) NSD2NPC1PLA2G7MEN1KMT2A
SCHEMBL6713262 0.88 GRIK1 (0.41) NSD2PLA2G7MEN1KMT2AGRIK1
SCHEMBL6914610 0.88 GRIK1 (0.37) NSD2NPC1PLA2G7MEN1KMT2A

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 NSD2 3824/4885ALDH1A1 123/4885NPC1 3891/4885

“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.