SCHEMBL6834035

SCHEMBL6834035

CCN(C(C)=O)c1ccc2onc(C(=O)Nc3ccc(C#N)cc3C(=O)O)c2c1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALB P02768 2/20 0.38
HIF1A Q16665 9/20 0.36
CDK2 P24941 1/20 0.35
PGR P06401 1/20 0.35
GHSR Q92847 1/20 0.34
PPARG P37231 1/20 0.33
CYSLTR2 Q9NS75 1/20 0.33
CYSLTR1 Q9Y271 1/20 0.33
ADORA2A P29274 1/20 0.33
ADORA2B P29275 1/20 0.33
ADORA1 P30542 1/20 0.33
F10 P00742 1/20 0.33
TXK P42681 1/20 0.32
ITK Q08881 1/20 0.32
PDE10A Q9Y233 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
SCHEMBL6834138 0.88 HIF1A (0.46) ALBHIF1ACDK2F10PDE10A
SCHEMBL6830530 0.87 ALB (0.40) ALBHIF1ACDK2GHSRPPARG
SCHEMBL6833108 0.83 HIF1A (0.39) ALBHIF1ACDK2PPARGPDE10A
SCHEMBL6818893 0.82 ALDH1A1 (0.49) ALB
SCHEMBL6835869 0.82 HIF1A (0.41) ALBHIF1APPARG
SCHEMBL6818914 0.82 HIF1A (0.39) ALBHIF1ACDK2PGRF10
SCHEMBL6814370 0.81 ALB (0.42) ALBHIF1ACDK2PDE10A
SCHEMBL6830124 0.81 AKR1C2 (0.43) ALBHIF1ACDK2
SCHEMBL6830490 0.80 HIF1A (0.55) ALBHIF1ACDK2
SCHEMBL6834186 0.79 HIF1A (0.49) ALBHIF1ACDK2

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 1417/4885HIF1A 220/4885CDK2 4509/4885

“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.