SCHEMBL6833802

SCHEMBL6833802

O=C(O)c1cc(Br)ccc1NC(=O)c1noc2ccc(S(=O)(=O)N3CCOCC3)cc12

nearest known ligand 0.66

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALB P02768 8/20 0.66
LMNA P02545 2/20 0.49
MAPT P10636 1/20 0.49
GAA P10253 1/20 0.48
KDM4E B2RXH2 2/20 0.47
ALDH1A1 P00352 2/20 0.47
RXFP1 Q9HBX9 1/20 0.47
PPARG P37231 1/20 0.47
PPARD Q03181 1/20 0.47
PPARA Q07869 1/20 0.47
USP2 O75604 2/20 0.46
CREBBP Q92793 1/20 0.46
HPGD P15428 1/20 0.45
HSD17B10 Q99714 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45

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
SCHEMBL6833780 0.93 ALB (0.55) ALBLMNAMAPTKDM4EALDH1A1
SCHEMBL6833124 0.88 ALB (0.69) ALBLMNAMAPTGAAKDM4E
SCHEMBL6833908 0.84 CA1 (0.45) ALBKDM4E
SCHEMBL6710405 0.83 ALB (0.46) ALBLMNAMAPTGAAKDM4E
SCHEMBL6711700 0.83 ALB (0.46) ALBLMNAMAPTGAAKDM4E
SCHEMBL6833947 0.81 AKR1C2 (0.51) MAPTKDM4EALDH1A1MEN1KMT2A
SCHEMBL6833153 0.81 METAP2 (0.46) ALBMAPTKDM4EMEN1KMT2A
SCHEMBL6834683 0.81 ALB (0.59) ALBLMNAMAPTALDH1A1RXFP1
SCHEMBL6822001 0.81 MEN1 (0.43) ALBLMNAMAPTGAAKDM4E
SCHEMBL6346566 0.79 ALB (1.00) ALBGAAALDH1A1PPARGPPARD

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 1417/4885LMNA 3376/4885MAPT 4759/4885

“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.