SCHEMBL6712192

SCHEMBL6712192

O=C(Nc1ccc(Br)cc1-c1nnn[nH]1)c1cc2cccc(S(=O)(=O)c3ccccc3)c2[nH]1

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 2/20 0.38
HIF1A Q16665 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
GPR35 Q9HC97 4/20 0.38
BCAT1 P54687 1/20 0.37
NSD2 O96028 1/20 0.36
TP53 P04637 3/20 0.33
POLB P06746 2/20 0.33
MAPT P10636 2/20 0.33

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
SCHEMBL6710290 0.91 NSD2 (0.37) RXFP1BCAT1NSD2TP53POLB
SCHEMBL6707829 0.90 PLCG2 (0.38) RXFP1BCAT1NSD2TP53POLB
SCHEMBL6712405 0.88 PLA2G7 (0.35) RXFP1BCAT1NSD2TP53POLB
SCHEMBL6711741 0.85 HIF1A (0.47) RXFP1HIF1ANPSR1GPR35NSD2
SCHEMBL6710188 0.84 GRIK1 (0.40) RXFP1HIF1ANPSR1GPR35BCAT1
SCHEMBL6709885 0.84 GPR35 (0.37) RXFP1HIF1ANPSR1GPR35NSD2
SCHEMBL6707728 0.84 PABPC1 (0.39) RXFP1HIF1ANPSR1GPR35POLB
SCHEMBL6709089 0.83 RXFP1 (0.38) RXFP1HIF1ANPSR1GPR35NSD2
SCHEMBL6707722 0.83 NSD2 (0.50) RXFP1HIF1ANPSR1GPR35NSD2
SCHEMBL6713465 0.83 GPR35 (0.43) RXFP1HIF1ANPSR1GPR35

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 3836/4885HIF1A 296/4885NPSR1 2999/4885

“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.