SCHEMBL162452

SCHEMBL162452

CCCCNC(=O)c1ccsc1[O]

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.60
TSHR P16473 1/20 0.60
HPGD P15428 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.49
NAAA Q02083 3/20 0.48
ALDH1A1 P00352 2/20 0.47
CYP1A2 P05177 1/20 0.47
GAA P10253 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
MAPT P10636 1/20 0.47
ALOX15 P16050 3/20 0.46
NR5A2 O00482 1/20 0.46
NR5A1 Q13285 1/20 0.46
LMNA P02545 1/20 0.46
RAB9A P51151 1/20 0.43
HDAC3 O15379 1/20 0.43

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
SCHEMBL163032 0.90 L3MBTL1 (0.47) HTTTSHRHPGDSMN1; SMN2NAAA
SCHEMBL162766 0.83 L3MBTL1 (0.43) HTTTSHRHPGDSMN1; SMN2ALDH1A1
SCHEMBL13858935 0.81 TSHR (0.57) HTTTSHRHPGDSMN1; SMN2NAAA
SCHEMBL7810359 0.78 ALOX15 (0.55) HTTTSHRHPGDSMN1; SMN2NAAA
SCHEMBL13858907 0.78 HPGD (0.55) HTTTSHRHPGDSMN1; SMN2NAAA
SCHEMBL20436876 0.76 NAAA (0.54) HTTTSHRHPGDSMN1; SMN2NAAA
SCHEMBL19210845 0.75 TSHR (1.00) HTTTSHRHPGDSMN1; SMN2NAAA
SCHEMBL163131 0.75 GAA (0.47) HTTTSHRHPGDSMN1; SMN2ALDH1A1
SCHEMBL14811748 0.75 TSHR (0.71) HTTTSHRHPGDSMN1; SMN2NAAA
SCHEMBL164069 0.73 TSHR (0.80) HTTTSHRHPGDSMN1; SMN2NAAA

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 HTT 72/4885TSHR 4862/4885HPGD 2718/4885

“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.