SCHEMBL6830574

SCHEMBL6830574

CC(=O)Nc1cccc(-c2ccc3onc(C(=O)Nc4ccc(C#N)cc4C(=O)OC(C)(C)C)c3c2)c1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 6/20 0.44
ABCG2 Q9UNQ0 1/20 0.37
MAP4K4 O95819 1/20 0.37
TP53 P04637 2/20 0.37
RXFP1 Q9HBX9 2/20 0.37
CHEK1 O14757 1/20 0.37
POLB P06746 2/20 0.36
NR1H4 Q96RI1 1/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPK14 Q16539 1/20 0.36
HSD17B1 P14061 1/20 0.36
HSD17B2 P37059 1/20 0.36
CSNK2A1 P68400 1/20 0.35
PPARG P37231 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
MAPT P10636 1/20 0.35
CYP17A1 P05093 1/20 0.35

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
SCHEMBL6817841 0.89 HIF1A (0.50) HIF1AABCG2MAP4K4TP53RXFP1
SCHEMBL7069805 0.85 HIF1A (0.38) HIF1ARXFP1NR1H4ALDH1A1PPARG
SCHEMBL6815114 0.83 HIF1A (0.37) HIF1AALDH1A1RAB9AMAPT
SCHEMBL6822117 0.83 HIF1A (0.37) HIF1ATP53POLBALDH1A1MAPT
SCHEMBL6818161 0.82 HIF1A (0.50) HIF1AABCG2TP53RXFP1POLB
SCHEMBL6817726 0.81 HIF1A (0.41) HIF1ARXFP1PPARG
SCHEMBL6830643 0.80 ALB (0.36) HIF1ATP53POLBALDH1A1MAPT
SCHEMBL6813916 0.79 HIF1A (0.46) HIF1AABCG2TP53RXFP1POLB
SCHEMBL6835869 0.79 HIF1A (0.41) HIF1APPARG
SCHEMBL6834186 0.78 HIF1A (0.49) HIF1A

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 HIF1A 220/4885ABCG2 1766/4885MAP4K4 2971/4885

“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.