SCHEMBL6819161

SCHEMBL6819161

COCCOCCCSc1cnc(C(=O)Nc2ccc(C#N)cc2C(=O)O)cn1

nearest known ligand 0.79

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALB P02768 2/20 0.79
PDE10A Q9Y233 2/20 0.36
PLK1 P53350 4/20 0.35
PYGL P06737 1/20 0.35
PYGM P11217 1/20 0.35
F10 P00742 1/20 0.35
BACE1 P56817 2/20 0.34
GPR6 P46095 1/20 0.34
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
TRPM4 Q8TD43 1/20 0.34
AKR1C2 P52895 1/20 0.33
AKR1C1 Q04828 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
MCL1 Q07820 1/20 0.33
BCL2A1 Q16548 1/20 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
SCHEMBL6830537 0.88 ALB (1.00) ALBPDE10APLK1F10KMT2A
SCHEMBL6821338 0.88 ALB (0.60) ALBF10AKR1C2AKR1C1
SCHEMBL6834094 0.87 ALB (0.59) ALBPLK1F10KMT2AMEN1
SCHEMBL6818627 0.87 ALB (0.59) ALBPLK1KMT2AMEN1AKR1C2
SCHEMBL6818796 0.87 ALB (0.59) ALBPLK1F10KMT2AMEN1
SCHEMBL6819812 0.86 ALB (0.58) ALBPLK1F10AKR1C2AKR1C1
SCHEMBL6814498 0.86 ALB (0.58) ALBPLK1F10AKR1C2AKR1C1
SCHEMBL6822748 0.86 ALB (0.58) ALBPLK1F10AKR1C2AKR1C1
SCHEMBL6833718 0.86 ALB (0.58) ALBPLK1F10AKR1C2AKR1C1
SCHEMBL6819130 0.83 ALB (0.54) ALBPDE10APYGLPYGMF10

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 3 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
WO-2004018428-A1 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-20040110802-A1 Antibacterial benzoic acid derivatives GABRD, GABBR1, GABRA1 ALB 1417/4885PDE10A 4030/4885PLK1 4270/4885

“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.