SCHEMBL7086950

SCHEMBL7086950

Nc1c(Nc2cccnc2Cl)c(=O)c1=O

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.42
HTT P42858 2/20 0.42
RAB9A P51151 9/20 0.41
NPC1 O15118 7/20 0.41
MAPT P10636 3/20 0.40
ALDH1A1 P00352 2/20 0.40
LMNA P02545 1/20 0.40
RXFP1 Q9HBX9 1/20 0.39
KMT2A Q03164 7/20 0.39
MEN1 O00255 6/20 0.39
POLB P06746 2/20 0.39
KDM4E B2RXH2 2/20 0.39
RECQL P46063 1/20 0.39
CASP6 P55212 1/20 0.39
CTDSP1 Q9GZU7 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
GAA P10253 2/20 0.38

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
SCHEMBL7345513 0.78 MEN1 (0.49) SMN1; SMN2HTTRAB9ANPC1MAPT
SCHEMBL7670546 0.77 BTK (0.40) MAPTALDH1A1KMT2AMEN1L3MBTL1
SCHEMBL14797051 0.75 ADRA1D (0.41) SMN1; SMN2HTTRAB9ANPC1MAPT
SCHEMBL7090682 0.75 GAA (0.60) SMN1; SMN2HTTRAB9ANPC1MAPT
SCHEMBL7090800 0.71 MEN1 (0.50) SMN1; SMN2HTTRAB9ANPC1MAPT
SCHEMBL28015638 0.70 RAB9A (0.43) SMN1; SMN2HTTRAB9ANPC1MAPT
SCHEMBL1735748 0.69
SCHEMBL22975347 0.68 SMN1; SMN2 (0.49) SMN1; SMN2HTTRAB9ANPC1MAPT
Hydrochloric Acid SCHEMBL3645012 0.67 SMN1; SMN2 (0.47) SMN1; SMN2HTTRAB9ANPC1MAPT
SCHEMBL8668406 0.67 NPC1 (0.52) SMN1; SMN2HTTRAB9ANPC1MAPT

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
EP-1358160-A1 AMINAL DIONES AS POTASSIUM CHANNEL OPENERS Abbott Laboratories (US) 2003-11-05 EP disclosed
US-6495576-B2 N-(1-((3,4-DIOXO-2-(3-PYRIDINYLAMINO)-1-CYCLOBUTEN-1-YL)AMINO) -2,2-DIMETHYLPROPYL)-4-METHYLBENZAMIDE FOR EXAMPLE; TREATING BLADDER OVERACTIVITY, BENIGN PROSTATIC HYPERPLASIA, PREMATURE LABOR, AND SEXUAL DISORDERS ABBOTT LABORATORIES 2002-12-17 US disclosed
US-20020165264-A1 Aminal diones as potassium channel openers ABBOTT LABORATORIES 2002-11-07 US disclosed
US-20020147230-A1 Aminal Diones as potassium channel openers ABBOTT LABORATORIES 2002-10-10 US disclosed
WO-2002062761-A1 AMINAL DIONES AS POTASSIUM CHANNEL OPENERS ABBOTT LABORATORIES (US) 2002-08-15 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 (2 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-20020147230-A1 Aminal Diones as potassium channel openers KCNJ2, KCNJ11, KCNH1 SMN1; SMN2 557/4885HTT 3242/4885RAB9A 3503/4885
US-20020165264-A1 Aminal diones as potassium channel openers KCNJ2, KCNJ11, KCNH1 SMN1; SMN2 557/4885HTT 3242/4885RAB9A 3503/4885

“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.