SCHEMBL6710171

SCHEMBL6710171

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

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 1/20 0.38
BRPF1 P55201 1/20 0.37
ROCK1 Q13464 3/20 0.37
RXFP1 Q9HBX9 3/20 0.35
ATM Q13315 1/20 0.35
GRM4 Q14833 1/20 0.35
ALDH1A1 P00352 1/20 0.34
THRB P10828 1/20 0.34
RARA P10276 1/20 0.33
USP30 Q70CQ3 1/20 0.33
TNIK Q9UKE5 1/20 0.33
KAT2B Q92831 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
MAPT P10636 1/20 0.32
HIF1A Q16665 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32

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
SCHEMBL6709891 0.91 RXFP1 (0.46) GRIK1BRPF1ROCK1RXFP1ATM
SCHEMBL6714295 0.89 GRIK1 (0.41) GRIK1ROCK1RXFP1GRM4ALDH1A1
SCHEMBL6713409 0.88 TDP2 (0.42) BRPF1ROCK1RXFP1ATMGRM4
SCHEMBL6710478 0.88 MAPT (0.47) ALDH1A1MEN1KMT2AMAPTNPSR1
SCHEMBL6711838 0.86 MEN1 (0.43) ALDH1A1MEN1KMT2AMAPTNPSR1
SCHEMBL6709869 0.85 GRIK1 (0.38) GRIK1ROCK1GRM4ALDH1A1MEN1
SCHEMBL6713296 0.85 PYGM (0.40) GRIK1ROCK1RXFP1GRM4THRB
SCHEMBL6713718 0.85 HPGD (0.40) GRIK1ROCK1GRM4ALDH1A1
SCHEMBL6710127 0.84 ROCK1 (0.47) GRIK1ROCK1RXFP1GRM4MEN1
SCHEMBL6710124 0.84 NPC1 (0.43) GRIK1ALDH1A1MEN1KMT2AMAPT

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 GRIK1 3885/4885BRPF1 95/4885ROCK1 4830/4885

“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.