SCHEMBL6833939

SCHEMBL6833939

CCCCC(CC)C(=O)Nc1cccc2cc(C(=O)Nc3ccc(C#N)cc3C(=O)O)[nH]c12

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.48
MAPT P10636 2/20 0.39
MAPK1 P28482 2/20 0.39
TDP1 Q9NUW8 1/20 0.39
NR1H4 Q96RI1 1/20 0.38
MEN1 O00255 1/20 0.37
ALDH1A1 P00352 1/20 0.37
KMT2A Q03164 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
ALB P02768 2/20 0.37
PTPN2 P17706 1/20 0.37
PTPN1 P18031 1/20 0.37
PTPN6 P29350 1/20 0.37
CDC25B P30305 1/20 0.37
PTPN11 Q06124 1/20 0.37
POLB P06746 1/20 0.37
PLK1 P53350 3/20 0.36

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
SCHEMBL6833975 0.93 MAPK1 (0.42) MAPTMAPK1TDP1NR1H4ALB
SCHEMBL6834031 0.87 MAPT (0.43) MAPTMAPK1TDP1NR1H4ALDH1A1
SCHEMBL6835693 0.85 POLB (0.47) ALDH1A1ALBPTPN2PTPN1PTPN6
SCHEMBL6833233 0.85 MAPT (0.42) MAPTMAPK1TDP1NR1H4ALDH1A1
SCHEMBL6833331 0.85 PTPN2 (0.44) PTPN2PTPN1PTPN6CDC25BPTPN11
SCHEMBL6833287 0.84 PLK1 (0.55) MAPTNR1H4MEN1KMT2ASMN1; SMN2
SCHEMBL6834575 0.84 PTPN2 (0.46) PTPN2PTPN1PTPN6CDC25BPTPN11
SCHEMBL6834131 0.84 PTPN2 (0.46) PTPN2PTPN1PTPN6CDC25BPTPN11
SCHEMBL6833910 0.84 KDM4E (0.45) MAPTMAPK1TDP1NR1H4ALDH1A1
SCHEMBL6830151 0.83 ALB (0.42) MAPTMAPK1TDP1NR1H4KMT2A

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 claimed
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 L3MBTL1 2096/4885MAPT 4759/4885MAPK1 2575/4885

“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.