SCHEMBL6712018

SCHEMBL6712018

O=C(Nc1ccc(Cl)cc1-c1noc(=O)[nH]1)c1cc2cccc(NC(=O)c3ccccc3-c3ccccc3)c2[nH]1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 1/20 0.42
CHRNB4 P30926 1/20 0.42
CHRNA3 P32297 1/20 0.42
CHRNA4 P43681 1/20 0.42
NHERF1 O14745 2/20 0.42
GRIK1 P39086 1/20 0.41
PLCG2 P16885 1/20 0.39
SERPINE1 P05121 2/20 0.39
STK33 Q9BYT3 1/20 0.38
KDM4E B2RXH2 1/20 0.38
POLB P06746 1/20 0.38
MAPT P10636 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
TDP1 Q9NUW8 1/20 0.38

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
SCHEMBL6713155 0.91 SERPINE1 (0.48) NHERF1GRIK1PLCG2SERPINE1STK33
SCHEMBL6711794 0.90 ALDH1A1 (0.46) CHRNB2CHRNB4CHRNA3CHRNA4GRIK1
SCHEMBL6712036 0.90 KCNMA1 (0.45) NHERF1GRIK1PLCG2STK33KDM4E
SCHEMBL6710141 0.90 GRIK1 (0.44) NHERF1GRIK1PLCG2SERPINE1STK33
SCHEMBL6707858 0.89 MEN1 (0.47) GRIK1PLCG2MAPTTDP1
SCHEMBL6709960 0.88 CHRNB2 (0.41) CHRNB2CHRNB4CHRNA3CHRNA4MAPT
SCHEMBL6708655 0.87 NHERF1 (0.46) NHERF1GRIK1PLCG2STK33
SCHEMBL6713646 0.87 NHERF1 (0.40) NHERF1GRIK1PLCG2KDM4E
SCHEMBL6708859 0.86 PLA2G7 (0.41) NHERF1GRIK1PLCG2
SCHEMBL6709173 0.86 GRIK1 (0.44) NHERF1GRIK1PLCG2STK33KDM4E

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 2 patents. 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
WO-2004018461-A2 ANTIBACTERIAL BENZOIC ACID DERIVATIVES PHARMACIA & UPJOHN COMPANY LLC (US) 2004-03-04 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-20040142981-A1 Antibacterial benzoic acid derivatives GABRD, PHB1, GABBR1 CHRNB2 4882/4885CHRNB4 4880/4885CHRNA3 4883/4885

“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.