SCHEMBL2885210

SCHEMBL2885210

O=C(Nc1ccccc1)c1ccccc1-n1cnnn1

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.81
RAB9A P51151 1/20 0.64
JAK2 O60674 2/20 0.63
JAK1 P23458 2/20 0.63
MEN1 O00255 5/20 0.56
KMT2A Q03164 5/20 0.56
ALDH1A1 P00352 4/20 0.56
KDM4E B2RXH2 4/20 0.56
MAPT P10636 2/20 0.56
POLB P06746 1/20 0.56
MITF O75030 1/20 0.56
GAA P10253 1/20 0.56
TDP1 Q9NUW8 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
PKM P14618 1/20 0.52
TP53 P04637 2/20 0.50
SMN1; SMN2 Q16637 1/20 0.49
RXFP1 Q9HBX9 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
LMNA P02545 1/20 0.47

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
SCHEMBL4925703 0.82 NPC1 (0.58) NPC1RAB9AJAK2JAK1MEN1
SCHEMBL6429865 0.81 NPC1 (0.55) NPC1RAB9AMEN1KMT2AALDH1A1
SCHEMBL13995836 0.80 NPC1 (0.68) NPC1RAB9AJAK2JAK1MEN1
SCHEMBL1663908 0.80 NPC1 (0.64) NPC1RAB9AJAK2JAK1MEN1
SCHEMBL24040867 0.79 NPC1 (0.63) NPC1RAB9AJAK2JAK1MEN1
SCHEMBL30444401 0.77 NPC1 (0.57) NPC1RAB9AJAK2JAK1MEN1
SCHEMBL3328193 0.77 NPC1 (0.57) NPC1RAB9AJAK2JAK1MEN1
SCHEMBL4440201 0.77 NPC1 (0.60) NPC1JAK2JAK1MEN1KMT2A
SCHEMBL17318545 0.76 RAB9A (0.66) NPC1RAB9AJAK2MEN1KMT2A
SCHEMBL16355148 0.75 KMT2A (0.79) NPC1RAB9AJAK2JAK1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100286149-A1 NOVEL BENZAMIDE DERIVATIVES USEFUL AS POTASSIUM CHANNEL MODULATORS NEUROSEARCH A/S (DK) 2010-11-11 US disclosed
EP-2212303-A1 NOVEL BENZAMIDE DERIVATIVES USEFUL AS POTASSIUM CHANNEL MODULATORS NeuroSearch AS (DK) 2010-08-04 EP disclosed
WO-2009068509-A1 NOVEL BENZAMIDE DERIVATIVES USEFUL AS POTASSIUM CHANNEL MODULATORS NEUROSEARCH A/S (DK) 2009-06-04 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-20100286149-A1 NOVEL BENZAMIDE DERIVATIVES USEFUL AS POTASSIUM CHANNEL MODULATORS KCNA2, KCNJ2, KCNB2 NPC1 1201/4885RAB9A 1720/4885JAK2 4256/4885

“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.