SCHEMBL6709891

SCHEMBL6709891

Cn1c(C(=O)Nc2ccc(Cl)cc2-c2noc(=O)[nH]2)cc2ccc(NS(C)(=O)=O)cc21

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 1/20 0.46
ROCK1 Q13464 3/20 0.41
GRIK1 P39086 1/20 0.40
GRM4 Q14833 1/20 0.39
BRPF1 P55201 1/20 0.37
TDP2 O95551 1/20 0.37
F11 P03951 5/20 0.36
KLKB1 P03952 4/20 0.36
F10 P00742 2/20 0.36
CMKLR1 Q99788 1/20 0.36
ATM Q13315 1/20 0.35
CPT1A P50416 1/20 0.35
CPT1B Q92523 1/20 0.35
ALDH1A1 P00352 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
SCHEMBL6710171 0.91 GRIK1 (0.38) RXFP1ROCK1GRIK1GRM4BRPF1
SCHEMBL6713555 0.89 RXFP1 (0.46) RXFP1ROCK1GRIK1GRM4F11
SCHEMBL6713409 0.89 TDP2 (0.42) RXFP1ROCK1GRM4BRPF1TDP2
SCHEMBL6709009 0.88 MAPT (0.41) RXFP1ROCK1ALDH1A1
SCHEMBL6711388 0.86 MEN1 (0.44) RXFP1GRM4ATMALDH1A1
SCHEMBL6711593 0.85 RXFP1 (0.43) RXFP1ROCK1GRIK1GRM4F11
SCHEMBL6710298 0.85 GRM4 (0.51) RXFP1ROCK1GRIK1GRM4
SCHEMBL6711779 0.85 RXFP1 (0.43) RXFP1ROCK1GRIK1GRM4ALDH1A1
SCHEMBL6713186 0.85 RXFP1 (0.42) RXFP1ROCK1GRIK1GRM4F11
SCHEMBL6710208 0.85 RXFP1 (0.44) RXFP1ROCK1GRIK1GRM4F11

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 RXFP1 3836/4885ROCK1 4830/4885GRIK1 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.