SCHEMBL162196

SCHEMBL162196

CNC(=O)n1ccc([O])n1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SCN4A P35499 1/20 0.47
BCHE P06276 1/20 0.33
ACHE P22303 1/20 0.33
POLB P06746 1/20 0.32
PLAU P00749 1/20 0.32
ELANE P08246 1/20 0.32
MAPT P10636 1/20 0.31
ALDH1A1 P00352 1/20 0.31
BAZ2B Q9UIF8 1/20 0.31
GAA P10253 1/20 0.30
SMN1; SMN2 Q16637 2/20 0.30
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL9507822 0.80 NOS1 (0.50) SCN4APLAUELANEMAPTALDH1A1
SCHEMBL165474 0.76 KMT2A (0.38) SCN4ABCHEPLAUELANEMAPT
SCHEMBL23583965 0.76 SCN4A (0.43) SCN4APLAUELANEMAPTALDH1A1
SCHEMBL20189189 0.74 SCN4A (0.46) SCN4AACHEPOLBPLAUELANE
SCHEMBL166278 0.74 MAPT (0.43) POLBMAPTALDH1A1SMN1; SMN2RAB9A
SCHEMBL20189387 0.73 SCN4A (0.42) SCN4APLAUELANEMAPTALDH1A1
SCHEMBL161442 0.69 KMT2A (0.48) BCHEPOLBMAPTSMN1; SMN2NPC1
SCHEMBL159357 0.68 BCHE (0.38) BCHEPOLBMAPTALDH1A1KMT2A
SCHEMBL162414 0.68 P2RX4 (0.38) BCHEPLAUELANEMAPTALDH1A1
SCHEMBL9260204 0.67 SCN4A (0.40) SCN4AALDH1A1SMN1; SMN2NPC1KMT2A

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-9856210-B2 Pharmaceutical composition for prevention and treatment of amyotrophic lateral sclerosis KYOTO UNIVERSITY (JP) 2018-01-02 US disclosed
EP-2611437-B1 PHARMACEUTICAL COMPOSITION FOR PREVENTION AND TREATMENT OF AMYOTROPHIC LATERAL SCLEROSIS UNIV KYOTO (JP) 2017-03-29 EP disclosed
US-20130225642-A1 PHARMACEUTICAL COMPOSITION FOR PREVENTION AND TREATMENT OF AMYOTROPHIC LATERAL SCLEROSIS KYOTO UNIVERSITY (JP) 2013-08-29 US disclosed
EP-2611437-A1 PHARMACEUTICAL COMPOSITION FOR PREVENTION AND TREATMENT OF AMYOTROPHIC LATERAL SCLEROSIS Kyoto University (JP) 2013-07-10 EP disclosed
WO-2012029994-A1 PHARMACEUTICAL COMPOSITION FOR PREVENTION AND TREATMENT OF AMYOTROPHIC LATERAL SCLEROSIS KYOTO UNIVERSITY (JP) 2012-03-08 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-20130225642-A1 PHARMACEUTICAL COMPOSITION FOR PREVENTION AND TREATMENT OF AMYOTROPHIC LATERAL SCLEROSIS SMN1; SMN2, SOD1, SOD3 SCN4A 2533/4885BCHE 37/4885ACHE 21/4885

“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.