SCHEMBL6835638

SCHEMBL6835638

O=C(Nc1ccc(I)cc1C(=O)O)c1cc(-c2ccccc2)on1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
STAT3 P40763 1/20 0.58
STAT1 P42224 1/20 0.58
MEN1 O00255 5/20 0.57
KMT2A Q03164 5/20 0.57
NPC1 O15118 4/20 0.57
ALDH1A1 P00352 4/20 0.55
PPARG P37231 1/20 0.55
NCOA2 Q15596 1/20 0.55
NCOA1 Q15788 1/20 0.55
NCOA3 Q9Y6Q9 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.54
MAPT P10636 2/20 0.52
RAB9A P51151 2/20 0.52
XBP1 P17861 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
PTPRC P08575 1/20 0.51
PTPN2 P17706 1/20 0.51
PTPN1 P18031 1/20 0.51
PTPRA P18433 1/20 0.51
PTPRB P23467 1/20 0.51

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
SCHEMBL6818030 0.88 MEN1 (0.66) STAT3STAT1MEN1KMT2ANPC1
SCHEMBL6813965 0.86 MEN1 (0.72) STAT3STAT1MEN1KMT2ANPC1
SCHEMBL6833101 0.85 KMT2A (0.53) MEN1KMT2ANPC1ALDH1A1PPARG
SCHEMBL6835694 0.85 KMT2A (0.49) STAT3STAT1MEN1KMT2ANPC1
SCHEMBL6813729 0.83 TDP1 (0.55) STAT3STAT1MEN1KMT2ANPC1
SCHEMBL13902149 0.78 STAT3 (0.68) STAT3STAT1MEN1KMT2ANPC1
SCHEMBL24773667 0.76 ACR (0.71) STAT3STAT1MEN1KMT2ANPC1
SCHEMBL17731968 0.76 THRB (0.80) STAT3STAT1MEN1KMT2ANPC1
SCHEMBL6833999 0.76 NPC1 (0.61) MEN1KMT2ANPC1ALDH1A1MAPT
SCHEMBL6833885 0.75 TDP1 (0.49) STAT3STAT1MEN1KMT2ANPC1

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 STAT3 943/4885STAT1 442/4885MEN1 4132/4885

“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.