SCHEMBL6830559

SCHEMBL6830559

N#Cc1ccc(NC(=O)c2cc3cccc(Cl)c3[nH]2)c(C(=O)O)c1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NHERF1 O14745 1/20 0.45
ALB P02768 1/20 0.45
PRSS12 P56730 1/20 0.42
TRPM4 Q8TD43 1/20 0.41
AKR1C4 P17516 1/20 0.41
AKR1C3 P42330 1/20 0.41
AKR1C2 P52895 1/20 0.41
AKR1C1 Q04828 1/20 0.41
NSD2 O96028 1/20 0.41
MAP3K5 Q99683 1/20 0.40
HTT P42858 1/20 0.40
HRH4 Q9H3N8 1/20 0.39
TAS1R3 Q7RTX0 1/20 0.39
TAS1R1 Q7RTX1 1/20 0.39
TAS1R2 Q8TE23 1/20 0.39
PLCG2 P16885 1/20 0.39
SERPINE1 P05121 1/20 0.39

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
SCHEMBL6818302 0.87 NSD2 (0.58) NHERF1ALBNSD2HRH4
SCHEMBL6833085 0.87 ALB (0.43) NHERF1ALBNSD2HTTHRH4
SCHEMBL6830460 0.87 TRPM4 (0.42) NHERF1ALBPRSS12TRPM4
SCHEMBL6834154 0.86 KMT2A (0.49) NHERF1ALBAKR1C4AKR1C3AKR1C2
SCHEMBL6833087 0.85 MEN1 (0.44) NHERF1ALBPRSS12TRPM4
SCHEMBL6833137 0.85 MAP3K5 (0.44) NHERF1ALBNSD2MAP3K5
SCHEMBL6834115 0.85 ALB (0.47) ALBAKR1C4AKR1C3AKR1C2AKR1C1
SCHEMBL6835708 0.85 CCKAR (0.51) NHERF1
SCHEMBL6834472 0.84 ALB (0.43) NHERF1ALBPRSS12NSD2
SCHEMBL6830877 0.84 AKR1C2 (0.48) NHERF1ALBAKR1C4AKR1C3AKR1C2

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-20040110802-A1 Antibacterial benzoic acid derivatives PHARMACIA & UPJOHN COMPANY 2004-06-10 US claimed
US-20040110802-A1 Antibacterial benzoic acid derivatives PHARMACIA & UPJOHN COMPANY 2004-06-10 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-20040110802-A1 Antibacterial benzoic acid derivatives GABRD, GABBR1, GABRA1 NHERF1 1142/4885ALB 1417/4885PRSS12 4112/4885

“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.