SCHEMBL6710059

SCHEMBL6710059

CCCCCCC(=O)Nc1cccc2cc(C(=O)Nc3ccc(Cl)cc3-c3noc(=O)[nH]3)[nH]c12

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 5/20 0.42
HDAC1 Q13547 5/20 0.42
GRIK1 P39086 1/20 0.40
SOAT1 P35610 2/20 0.39
PLCG2 P16885 1/20 0.38
CMKLR1 Q99788 1/20 0.38
POLB P06746 1/20 0.37
EP300 Q09472 1/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
ALOX15 P16050 1/20 0.36
PTPN2 P17706 1/20 0.36
PTPN1 P18031 1/20 0.36
PTPN6 P29350 1/20 0.36
CDC25B P30305 1/20 0.36
PTPN11 Q06124 1/20 0.36
PLA2G7 Q13093 1/20 0.35

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
SCHEMBL6756845 1.00 HDAC3 (0.42) HDAC3HDAC1GRIK1SOAT1PLCG2
SCHEMBL6713462 0.99 HDAC3 (0.41) HDAC3HDAC1GRIK1SOAT1PLCG2
SCHEMBL6710607 0.98 GRIK1 (0.41) HDAC3HDAC1GRIK1SOAT1PLCG2
SCHEMBL6712433 0.94 GRIK1 (0.42) HDAC3HDAC1GRIK1PLCG2CMKLR1
SCHEMBL6713962 0.93 HDAC3 (0.42) HDAC3HDAC1GRIK1PLCG2POLB
SCHEMBL6709877 0.91 GRIK1 (0.43) GRIK1PLCG2POLBALDH1A1ALOX15
SCHEMBL6714306 0.91 HDAC3 (0.40) HDAC3HDAC1GRIK1PLCG2POLB
SCHEMBL6709836 0.91 HDAC3 (0.42) HDAC3HDAC1GRIK1SOAT1POLB
SCHEMBL6712479 0.91 HDAC3 (0.42) HDAC3HDAC1GRIK1SOAT1POLB
SCHEMBL6707741 0.90 HDAC1 (0.40) HDAC3HDAC1GRIK1PLCG2ALOX15

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 HDAC3 2281/4885HDAC1 1910/4885GRIK1 3885/4885

“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.