SCHEMBL752687

SCHEMBL752687

COCC(=O)N1CCN(S(=O)(=O)c2ccc(C)cc2)CC1

nearest known ligand 0.68

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.67
RAB9A P51151 1/20 0.67
MDM2 Q00987 1/20 0.67
PKM P14618 5/20 0.64
GAA P10253 3/20 0.64
ALOX15 P16050 1/20 0.61
KMT2A Q03164 3/20 0.60
YAP1 P46937 1/20 0.60
TEAD4 Q15561 1/20 0.60
ALDH1A1 P00352 1/20 0.59
MEN1 O00255 1/20 0.58
NPSR1 Q6W5P4 1/20 0.57

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
SCHEMBL751873 0.85 POLB (0.58) PKMGAAKMT2AALDH1A1MEN1
SCHEMBL752279 0.83 GAA (0.85) PKMGAAKMT2AALDH1A1MEN1
SCHEMBL20323444 0.83 YAP1 (0.84) NPC1RAB9AMDM2PKMGAA
SCHEMBL754116 0.82 NPC1 (0.69) NPC1RAB9AMDM2PKMGAA
SCHEMBL30386909 0.82 NPC1 (0.69) NPC1RAB9AMDM2PKMGAA
SCHEMBL752501 0.81 LMNA (0.88) PKMGAAKMT2AYAP1TEAD4
SCHEMBL752502 0.81 GAA (0.72) NPC1RAB9AMDM2PKMGAA
SCHEMBL19239018 0.80 PKM (0.63) NPC1RAB9AMDM2PKMGAA
SCHEMBL6744907 0.79 KMT2A (0.70) NPC1RAB9AMDM2PKMGAA
SCHEMBL14477863 0.79 KMT2A (0.70) NPC1RAB9AMDM2PKMGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170234881-A1 METHODS OF DIAGNOSING AND TREATING CANCER INSERM (INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE) (FR) 2017-08-17 US disclosed
US-20170234881-A1 METHODS OF DIAGNOSING AND TREATING CANCER INSERM (INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE) (FR) 2017-08-17 US disclosed
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.