SCHEMBL6709037

SCHEMBL6709037

O=C(Cc1ccccc1Cl)Nc1cccc2cc(C(=O)Nc3ccc(Br)cc3-c3noc(=O)[nH]3)[nH]c12

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PARP14 Q460N5 1/20 0.42
GRIK1 P39086 1/20 0.41
BACE1 P56817 4/20 0.40
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
ALDH1A1 P00352 1/20 0.35
PLA2G7 Q13093 1/20 0.35
KCNJ5 P48544 1/20 0.34
KCNJ3 P48549 1/20 0.34
NHERF1 O14745 1/20 0.34
KCNQ2 O43526 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
SCHEMBL6713652 0.92 GRIK1 (0.45) PARP14GRIK1BACE1MEN1KMT2A
SCHEMBL6710278 0.92 PARP14 (0.43) PARP14GRIK1MEN1KMT2AALDH1A1
SCHEMBL6707749 0.92 GRIK1 (0.42) GRIK1MEN1KMT2APLA2G7MAPT
SCHEMBL6712548 0.92 KMT2A (0.48) GRIK1BACE1MEN1KMT2AALDH1A1
SCHEMBL6707664 0.91 NSD2 (0.41) PARP14GRIK1MEN1KMT2AALDH1A1
SCHEMBL6707838 0.89 CSNK1D (0.44) MEN1KMT2AALDH1A1PLA2G7MAPT
SCHEMBL6710051 0.89 MEN1 (0.40) PARP14GRIK1MEN1KMT2AALDH1A1
SCHEMBL6708826 0.89 PLA2G7 (0.39) GRIK1MEN1KMT2AALDH1A1PLA2G7
SCHEMBL6707901 0.89 PARP14 (0.40) PARP14GRIK1ALDH1A1PLA2G7KCNJ5
SCHEMBL6712138 0.89 PARP14 (0.43) PARP14GRIK1BACE1MEN1KMT2A

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 PARP14 2597/4885GRIK1 3885/4885BACE1 3406/4885

“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.