SCHEMBL6833798

SCHEMBL6833798

N#Cc1ccc(NC(=O)c2noc3ccc(NCC(O)CO)cc23)c(C(=O)O)c1

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALB P02768 2/20 0.37
CDK2 P24941 3/20 0.36
HIF1A Q16665 10/20 0.35
EGLN2 Q96KS0 1/20 0.34
PPARG P37231 1/20 0.33
LRRK2 Q5S007 1/20 0.32
SCN9A Q15858 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 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
SCHEMBL6833569 0.88 CDK2 (0.40) ALBCDK2HIF1APPARGLRRK2
SCHEMBL6833108 0.87 HIF1A (0.39) ALBCDK2HIF1APPARG
SCHEMBL6833068 0.83 ALB (0.39) ALBCDK2HIF1APPARG
SCHEMBL6830652 0.83 ALB (0.44) ALBCDK2HIF1APPARG
SCHEMBL6835869 0.83 HIF1A (0.41) ALBHIF1APPARGLRRK2
SCHEMBL6834155 0.81 F2 (0.50) ALBHIF1ALRRK2
SCHEMBL6834064 0.80 ALB (0.42) ALBHIF1ALRRK2
SCHEMBL6833806 0.80 KDM4C (0.45) ALBHIF1A
SCHEMBL6834208 0.80 LMNA (0.49) CDK2HIF1AEGLN2PPARGKDM4E
SCHEMBL6814370 0.80 ALB (0.42) ALBCDK2HIF1A

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-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 ALB 1417/4885CDK2 4509/4885HIF1A 220/4885

“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.