SCHEMBL6710319

SCHEMBL6710319

O=C(Nc1ccc(Cl)cc1-c1nnn[nH]1)c1cc2cccc(NC(=O)c3ccccc3-c3ccccc3)c2[nH]1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 1/20 0.43
CHRNB4 P30926 1/20 0.43
CHRNA3 P32297 1/20 0.43
CHRNA4 P43681 1/20 0.43
NHERF1 O14745 2/20 0.43
SERPINE1 P05121 2/20 0.40
TDP1 Q9NUW8 1/20 0.38
HTT P42858 1/20 0.38
PLCG2 P16885 1/20 0.38
MAPT P10636 1/20 0.38
F10 P00742 2/20 0.38
PPARG P37231 1/20 0.38
PYGL P06737 1/20 0.37

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
SCHEMBL6710125 0.91 SERPINE1 (0.48) NHERF1SERPINE1PLCG2MAPTF10
SCHEMBL6712183 0.90 ALDH1A1 (0.47) CHRNB2CHRNB4CHRNA3CHRNA4HTT
SCHEMBL6710216 0.90 KCNMA1 (0.46) NHERF1HTTPLCG2PYGL
SCHEMBL6713754 0.90 SERPINE1 (0.43) NHERF1SERPINE1PLCG2
SCHEMBL6712030 0.88 CHRNB2 (0.41) CHRNB2CHRNB4CHRNA3CHRNA4HTT
SCHEMBL6711906 0.87 NHERF1 (0.46) NHERF1PLCG2F10PYGL
SCHEMBL6707792 0.86 NHERF1 (0.40) NHERF1HTT
SCHEMBL6708001 0.86 MEN1 (0.45) TDP1MAPT
SCHEMBL6711851 0.86 PTGES (0.40) NHERF1PLCG2F10
SCHEMBL6710112 0.86 MAP3K5 (0.45) NHERF1TDP1PLCG2MAPTF10

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-20040142981-A1 Antibacterial benzoic acid derivatives PHARMACIA & UPJOHN COMPANY 2004-07-22 US disclosed
WO-2004018461-A2 ANTIBACTERIAL BENZOIC ACID DERIVATIVES PHARMACIA & UPJOHN COMPANY LLC (US) 2004-03-04 WO 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 CHRNB2 4882/4885CHRNB4 4880/4885CHRNA3 4883/4885

“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.