SCHEMBL7071019

SCHEMBL7071019

Cc1noc(C)c1S(=O)(=O)Nc1ccc2cc(C(=O)Nc3ccc(C#N)cc3C(=O)O)n(C)c2c1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.44
TSHR P16473 1/20 0.44
ACLY P53396 1/20 0.42
MAPT P10636 7/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
NPSR1 Q6W5P4 2/20 0.41
TP53 P04637 1/20 0.40
POLB P06746 1/20 0.40
GAA P10253 2/20 0.40
NR3C2 P08235 2/20 0.40
HSD17B10 Q99714 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
LMNA P02545 1/20 0.39
ALB P02768 1/20 0.39
HPGD P15428 1/20 0.38
HTT P42858 1/20 0.38

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
SCHEMBL6834185 0.86 ACLY (0.45) ALDH1A1TSHRACLYMAPTMEN1
SCHEMBL7125792 0.85 ALDH1A1 (0.44) ALDH1A1TSHRACLYMAPTMEN1
SCHEMBL6707784 0.85 MAPT (0.39) ALDH1A1TSHRMAPTMEN1KMT2A
SCHEMBL6709982 0.84 MAPT (0.38) ALDH1A1TSHRMAPTMEN1KMT2A
SCHEMBL6835744 0.83 ALB (0.43) ALDH1A1NR3C2ALB
SCHEMBL6834548 0.82 BRD4 (0.41) MAPTTP53LMNAALB
SCHEMBL6818253 0.79 ROCK2 (0.42) MAPTTP53HSD17B10SMN1; SMN2LMNA
SCHEMBL6833349 0.79 PKLR (0.45) ALDH1A1MAPTMEN1KMT2ANPSR1
SCHEMBL6932562 0.78 ROCK2 (0.41) ALDH1A1MEN1KMT2AALBHTT
SCHEMBL6814610 0.77 ROCK2 (0.41) ALDH1A1MAPTMEN1KMT2ATP53

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 ALDH1A1 170/4885TSHR 3622/4885ACLY 986/4885

“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.