SCHEMBL6817841

SCHEMBL6817841

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

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 6/20 0.50
PTPN11 Q06124 3/20 0.42
POLB P06746 2/20 0.42
TP53 P04637 2/20 0.42
MAPT P10636 1/20 0.42
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
TSHR P16473 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ALDH1A1 P00352 1/20 0.41
ABCG2 Q9UNQ0 1/20 0.40
MAP4K4 O95819 1/20 0.40
RXFP1 Q9HBX9 2/20 0.40
CHEK1 O14757 1/20 0.40
HTT P42858 1/20 0.39
CA2 P00918 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
SCHEMBL6818161 0.93 HIF1A (0.50) HIF1APTPN11POLBTP53MAPT
SCHEMBL6817726 0.92 HIF1A (0.41) HIF1APTPN11RXFP1
SCHEMBL6835869 0.90 HIF1A (0.41) HIF1AHTT
SCHEMBL6813916 0.90 HIF1A (0.46) HIF1APTPN11POLBTP53MAPT
SCHEMBL6834186 0.89 HIF1A (0.49) HIF1AHTT
SCHEMBL6830574 0.89 HIF1A (0.44) HIF1APOLBTP53MAPTNPC1
SCHEMBL6817648 0.86 ABCG2 (0.42) PTPN11POLBTP53MAPTNPC1
SCHEMBL6931399 0.86 HIF1A (0.39) HIF1AMAPTALDH1A1
SCHEMBL6814788 0.84 ABCG2 (0.42) PTPN11POLBTP53MAPTNPC1
SCHEMBL6818851 0.83 HIF1A (0.40) HIF1APOLBTP53MAPTRXFP1

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 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 HIF1A 220/4885PTPN11 2924/4885POLB 637/4885

“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.