SCHEMBL1308355

SCHEMBL1308355

O=C(Nc1cc(Cl)ccc1C(=O)O)c1cc2cc(Cl)ccc2[nH]1

nearest known ligand 0.81

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NHERF1 O14745 6/20 0.81
F7 P08709 1/20 0.62
F3 P13726 1/20 0.62
MEN1 O00255 3/20 0.60
KMT2A Q03164 3/20 0.60
RXFP1 Q9HBX9 1/20 0.60
PYGL P06737 7/20 0.57
GRIK1 P39086 1/20 0.56
PKM P14618 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
NPC1 O15118 1/20 0.52
RAB9A P51151 1/20 0.52

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
SCHEMBL1306446 0.90 NHERF1 (0.74) NHERF1GRIK1NPC1RAB9A
SCHEMBL5401686 0.88 NHERF1 (0.78) NHERF1F7F3MEN1KMT2A
SCHEMBL1310023 0.84 NHERF1 (0.73) NHERF1F7F3MEN1KMT2A
SCHEMBL6376602 0.81 NHERF1 (0.62) NHERF1F7F3MEN1KMT2A
SCHEMBL31058769 0.80 NHERF1 (0.78) NHERF1F7F3MEN1KMT2A
5-Chloroindole-2-Carboxylic Acid SCHEMBL720582 0.78 F7 (1.00) NHERF1F7F3MEN1KMT2A
SCHEMBL5410224 0.78 NHERF1 (0.67) NHERF1F7F3MEN1KMT2A
SCHEMBL5405858 0.77 NHERF1 (0.67) NHERF1F7F3MEN1KMT2A
SCHEMBL1308714 0.77 MEN1 (0.76) MEN1KMT2AGRIK1PKMNPSR1
SCHEMBL14503746 0.77 NHERF1 (0.67) NHERF1F7F3MEN1KMT2A

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090042918-A1 Pyridopyrimidinone Inhibitors of PIM-1 and/or PIM-3 EXELIXIS, INC. (US) 2009-02-12 US claimed
WO-2004022525-A1 AMIDE DERIVATIVES AND THEIR USE AS CHLORIDE CHANNEL BLOCKERS NEUROSEARCH A/S (DK) 2004-03-18 WO claimed
US-8053454-B2 Pyridopyrimidinone inhibitors of PIM-1 and/or PIM-3 EXELIXIS, INC. (US) 2011-11-08 US disclosed
US-20090042918-A1 Pyridopyrimidinone Inhibitors of PIM-1 and/or PIM-3 EXELIXIS, INC. (US) 2009-02-12 US disclosed
WO-2004022525-A1 AMIDE DERIVATIVES AND THEIR USE AS CHLORIDE CHANNEL BLOCKERS NEUROSEARCH A/S (DK) 2004-03-18 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-20090042918-A1 Pyridopyrimidinone Inhibitors of PIM-1 and/or PIM-3 PIM1, PIM3, PIM2 NHERF1 764/4885F7 4026/4885F3 252/4885

“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.