SCHEMBL6710347

SCHEMBL6710347

CCCCC(CC)C(=O)Nc1cccc2cc(C(=O)Nc3ccc(Cl)cc3-c3nnn[nH]3)[nH]c12.COC(=O)CC(=O)Nc1cccc2cc(C(=O)Nc3ccc(Cl)cc3-c3nnn[nH]3)[nH]c12

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.34
PTK2B Q14289 3/20 0.34
MAPT P10636 2/20 0.33
MAPK1 P28482 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
POLB P06746 3/20 0.32
TP53 P04637 2/20 0.32
LMNA P02545 1/20 0.32
F10 P00742 2/20 0.32
PLCG2 P16885 1/20 0.32
PTK2 Q05397 1/20 0.31
HDAC3 O15379 1/20 0.31
HDAC1 Q13547 1/20 0.31
MAP3K5 Q99683 1/20 0.31

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
SCHEMBL6713158 0.88 MAPT (0.39) PTK2BMAPTMAPK1TDP1POLB
SCHEMBL6710354 0.86 PTK2B (0.31) TSHRPTK2BMAPTMAPK1TDP1
SCHEMBL6707718 0.85 L3MBTL1 (0.37) PTK2BMAPTMAPK1TDP1L3MBTL1
SCHEMBL6709327 0.84 MEN1 (0.44) PTK2BMAPTMAPK1TDP1POLB
SCHEMBL6707884 0.84 HDAC3 (0.40) PTK2BMAPTMAPK1TDP1POLB
SCHEMBL6711639 0.84 HDAC3 (0.40) PTK2BMAPTL3MBTL1POLBTP53
SCHEMBL6714199 0.84 HDAC3 (0.41) PTK2BMAPTMAPK1L3MBTL1POLB
SCHEMBL6710211 0.83 L3MBTL1 (0.43) PTK2BMAPTMAPK1TDP1L3MBTL1
SCHEMBL6710313 0.83 HDAC3 (0.43) PTK2BMAPTPOLBTP53LMNA
SCHEMBL6707825 0.83 HDAC3 (0.42) PTK2BMAPTPOLBTP53LMNA

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 TSHR 3901/4885PTK2B 4069/4885MAPT 4754/4885

“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.