SCHEMBL1608889

SCHEMBL1608889

NC(=O)C(OC(=O)c1cc2cc(Cl)ccc2[nH]1)c1ccc([N+](=O)[O-])cc1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GUSB P08236 3/20 0.51
F7 P08709 1/20 0.44
F3 P13726 1/20 0.44
OPRM1 P35372 1/20 0.43
PDGFRB P09619 1/20 0.42
PDGFRA P16234 1/20 0.42
PYGL P06737 6/20 0.41
LGALS8 O00214 1/20 0.41
LGALS3 P17931 1/20 0.41
FLT3 P36888 1/20 0.41
MEN1 O00255 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
KMT2A Q03164 1/20 0.40
HRH4 Q9H3N8 1/20 0.39

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
SCHEMBL741209 0.79 PDGFRB (0.58) GUSBF7F3OPRM1PDGFRB
SCHEMBL1608873 0.77 IDO1 (0.53) F7F3PDGFRBPDGFRAPYGL
SCHEMBL1608887 0.73 GUSB (0.58) GUSBPYGLNPC1HRH4
SCHEMBL26213276 0.72 KDM4E (0.67) F7F3PDGFRBPYGLFLT3
SCHEMBL6400662 0.71 GUSB (0.65) GUSBF7F3OPRM1PYGL
SCHEMBL5207050 0.69 HRH4 (0.59) GUSBPDGFRBPDGFRAMEN1KMT2A
SCHEMBL6323164 0.68 HRH4 (0.58) GUSBPDGFRBPDGFRALGALS8LGALS3
SCHEMBL764543 0.68 F7 (0.72) GUSBF7F3PYGLFLT3
SCHEMBL1608567 0.68 GUSB (0.60) GUSBPYGLHRH4
SCHEMBL3963537 0.67 F7 (0.66) F7F3PDGFRBPYGLFLT3

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-20110086885-A1 Indole-2-carboxylic acid amides PROSIDION LIMITED (GB) 2011-04-14 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-20110086885-A1 Indole-2-carboxylic acid amides IDO2, IDO1, CPT1A GUSB 2784/4885F7 2611/4885F3 1014/4885

“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.