SCHEMBL13846851

SCHEMBL13846851

Cc1cc(/C=C2\SC(=O)NC2=O)c(C)n1-c1cccc([N+](=O)[O-])c1

nearest known ligand 0.64

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ NR1H4 Q96RI1 8/20 0.64
▸ NPC1 O15118 4/20 0.64
▸ RAB9A P51151 4/20 0.64
▸ POLB P06746 3/20 0.64
▸ PPARA Q07869 1/20 0.62
▸ GLS O94925 5/20 0.62
▸ GLS2 Q9UI32 4/20 0.62
▸ ATM Q13315 1/20 0.60
▸ IGF1R P08069 1/20 0.58
▸ MAPT P10636 3/20 0.58
▸ LMNA P02545 1/20 0.58
▸ HPGD P15428 1/20 0.58
▸ MEN1 O00255 2/20 0.57
▸ ALDH1A1 P00352 2/20 0.57
▸ KMT2A Q03164 2/20 0.57
▸ NPSR1 Q6W5P4 2/20 0.57
▸ HSP90AA1 P07900 1/20 0.57
▸ MAPK1 P28482 1/20 0.56

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
SCHEMBL13846866 0.83 NR1H4 (0.86) NR1H4NPC1RAB9APOLBPPARA
SCHEMBL18545405 0.83 NR1H4 (0.86) NR1H4NPC1RAB9APOLBPPARA
SCHEMBL12009119 0.80 TCF4 (0.64) NPC1RAB9APOLBMAPTLMNA
SCHEMBL18545458 0.80 TCF4 (0.64) NPC1RAB9APOLBMAPTLMNA
SCHEMBL14325640 0.78 RAB9A (0.68) NR1H4NPC1RAB9APOLBPPARA
SCHEMBL13846877 0.77 NR1H4 (1.00) NR1H4NPC1RAB9APOLBPPARA
SCHEMBL12009029 0.77 MEN1 (0.57) NR1H4NPC1RAB9APOLBMAPT
SCHEMBL13846818 0.75 IGF1R (1.00) POLBIGF1RMAPTHPGDMEN1
SCHEMBL1250598 0.75 IGF1R (1.00) POLBIGF1RMAPTHPGDMEN1
SCHEMBL1250596 0.75 IGF1R (1.00) POLBIGF1RMAPTHPGDMEN1

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-20090123563-A1 Pharmaceutical Preparations Comprising Insulin, Zinc Ions and Zinc-Binding Ligand NOVO NORDISK A/S (DK) 2009-05-14 — — 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-20090123563-A1 Pharmaceutical Preparations Comprising Insulin, Zinc Ions and Zinc-Binding Ligand IAPP, IRS1, HBB NR1H4 391/4885NPC1 3787/4885RAB9A 1951/4885

“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.

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