SCHEMBL754116

SCHEMBL754116

Cc1ccc(S(=O)(=O)N2CCN(C(=O)CC(C)(C)C)CC2)cc1

nearest known ligand 0.69

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.69
RAB9A P51151 1/20 0.69
MDM2 Q00987 1/20 0.69
PKM P14618 6/20 0.66
GAA P10253 2/20 0.66
KMT2A Q03164 3/20 0.62
YAP1 P46937 1/20 0.61
TEAD4 Q15561 1/20 0.61
NPSR1 Q6W5P4 1/20 0.59
ALDH1A1 P00352 2/20 0.58
POLB P06746 2/20 0.58
HTT P42858 1/20 0.58
MEN1 O00255 1/20 0.58

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
SCHEMBL752526 0.87 POLB (0.62) NPC1RAB9AMDM2GAAKMT2A
SCHEMBL20323444 0.84 YAP1 (0.84) NPC1RAB9AMDM2PKMGAA
SCHEMBL30386909 0.83 NPC1 (0.69) NPC1RAB9AMDM2PKMGAA
SCHEMBL752687 0.82 NPC1 (0.67) NPC1RAB9AMDM2PKMGAA
SCHEMBL23996270 0.81 NPC1 (0.47) NPC1RAB9AMDM2PKMGAA
SCHEMBL6744907 0.80 KMT2A (0.70) NPC1RAB9AMDM2PKMGAA
SCHEMBL14477863 0.80 KMT2A (0.70) NPC1RAB9AMDM2PKMGAA
SCHEMBL4537086 0.79 PKM (0.88) NPC1RAB9APKMGAAKMT2A
SCHEMBL10724066 0.79 PKM (0.88) NPC1RAB9APKMGAAKMT2A
SCHEMBL565301 0.79 PKM (0.88) NPC1RAB9APKMGAAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2016034742-A1 METHODS OF DIAGNOSING AND TREATING CANCER INSERM (Institut National de la Santé et de la Recherche Médicale) (FR) 2016-03-10 WO disclosed
US-8138190-B2 Diaza heterocyclic amide compounds and their uses AMGEN INC. (US) 2012-03-20 US disclosed
US-8138190-B2 Diaza heterocyclic amide compounds and their uses AMGEN INC. (US) 2012-03-20 US disclosed
US-20090176768-A1 DIAZA HETEROCYCLIC AMIDE COMPOUNDS AND THEIR USES AMGEN INC. 2009-07-09 US disclosed
US-20090176768-A1 DIAZA HETEROCYCLIC AMIDE COMPOUNDS AND THEIR USES AMGEN INC. 2009-07-09 US disclosed
US-7524848-B2 Diaza heterocyclic amide compounds and their uses AMGEN INC. (US) 2009-04-28 US disclosed
US-7524848-B2 Diaza heterocyclic amide compounds and their uses AMGEN INC. (US) 2009-04-28 US disclosed
US-20070249626-A1 Diaza heterocyclic amide compounds and their uses AMGEN INC. 2007-10-25 US disclosed
US-20070249626-A1 Diaza heterocyclic amide compounds and their uses AMGEN INC. 2007-10-25 US 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-20090176768-A1 DIAZA HETEROCYCLIC AMIDE COMPOUNDS AND THEIR USES GPR119, GLP1R, INSR NPC1 2079/4885RAB9A 96/4885MDM2 2269/4885
US-20070249626-A1 Diaza heterocyclic amide compounds and their uses GPR119, GLP1R, INSR NPC1 2079/4885RAB9A 96/4885MDM2 2269/4885

“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.