SCHEMBL6709982

SCHEMBL6709982

Cc1noc(C)c1S(=O)(=O)Nc1ccc2cc(C(=O)Nc3ccc(C#N)cc3-c3nnn[nH]3)n(C)c2c1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.38
MEN1 O00255 4/20 0.37
KMT2A Q03164 4/20 0.37
NPSR1 Q6W5P4 2/20 0.37
NR3C2 P08235 3/20 0.37
TP53 P04637 1/20 0.36
POLB P06746 1/20 0.36
ALDH1A1 P00352 3/20 0.36
TSHR P16473 1/20 0.36
GAA P10253 2/20 0.36
HSD17B10 Q99714 1/20 0.36
LMNA P02545 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
ITK Q08881 1/20 0.35
HPGD P15428 1/20 0.34
HTT P42858 1/20 0.34
GALK1 P51570 1/20 0.34

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
SCHEMBL6710014 0.90 MAPT (0.40) MAPTMEN1KMT2ANPSR1TP53
SCHEMBL6711229 0.90 MAPT (0.45) MAPTMEN1KMT2ANPSR1TP53
SCHEMBL6707784 0.88 MAPT (0.39) MAPTMEN1KMT2ANPSR1NR3C2
SCHEMBL6710360 0.86 TDP2 (0.41) NR3C2
SCHEMBL6713399 0.84 BRD4 (0.37) NR3C2LMNA
SCHEMBL7071019 0.84 ALDH1A1 (0.44) MAPTMEN1KMT2ANPSR1NR3C2
SCHEMBL6710142 0.82 ROCK2 (0.41) TP53HSD17B10SMN1; SMN2
SCHEMBL6710299 0.81 BRD4 (0.42) MAPTMEN1KMT2ANPSR1ALDH1A1
SCHEMBL6707926 0.80 ROCK2 (0.40) MEN1KMT2AHTT
SCHEMBL6710229 0.79 NAMPT (0.40) MEN1KMT2AALDH1A1HPGDHTT

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-20040142981-A1 Antibacterial benzoic acid derivatives PHARMACIA & UPJOHN COMPANY 2004-07-22 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-20040142981-A1 Antibacterial benzoic acid derivatives GABRD, PHB1, GABBR1 MAPT 4754/4885MEN1 4100/4885KMT2A 3181/4885

“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.