SCHEMBL4618429

SCHEMBL4618429

CC(C)(C)OC(=O)NC1CCN(C(=O)c2ccc(C(C)(C)C)cc2)C1

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.59
KMT2A Q03164 6/20 0.59
NAMPT P43490 1/20 0.56
NPC1L1 Q9UHC9 2/20 0.56
RAB9A P51151 1/20 0.54
PARP1 P09874 1/20 0.51
CYP2C9 P11712 1/20 0.50
HSD11B1 P28845 1/20 0.50
CTSK P43235 2/20 0.49
ALDH1A1 P00352 1/20 0.49
HTT P42858 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
TSHR P16473 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
HPGD P15428 2/20 0.48
ALOX15 P16050 1/20 0.48
CFTR P13569 1/20 0.47

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
SCHEMBL4618143 0.93 MEN1 (0.68) MEN1KMT2ANAMPTNPC1L1RAB9A
SCHEMBL31267093 0.89 NAMPT (0.57) MEN1KMT2ANAMPTNPC1L1PARP1
SCHEMBL31267054 0.89 NAMPT (0.57) MEN1KMT2ANAMPTNPC1L1PARP1
SCHEMBL24185784 0.88 NAMPT (0.56) MEN1KMT2ANAMPTNPC1L1PARP1
SCHEMBL24185232 0.88 NAMPT (0.56) MEN1KMT2ANAMPTNPC1L1PARP1
SCHEMBL24185215 0.88 NAMPT (0.56) MEN1KMT2ANAMPTNPC1L1PARP1
SCHEMBL2610266 0.88 NAMPT (0.61) MEN1KMT2ANAMPTNPC1L1PARP1
SCHEMBL7939466 0.88 NAMPT (0.61) MEN1KMT2ANAMPTNPC1L1PARP1
SCHEMBL12644375 0.86 NAMPT (0.70) MEN1KMT2ANAMPTNPC1L1RAB9A
SCHEMBL16771644 0.85 NAMPT (0.53) NAMPTNPC1L1PARP1CYP2C9HSD11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1879859-A2 DIARYLSULFONE SULFONAMIDES AND USE THEROF Wyeth a Corporation of the State of Delaware (US) 2008-01-23 EP disclosed
US-20060276464-A1 Diarylsulfone sulfonamides and use thereof WYETH (US) 2006-12-07 US disclosed
WO-2006124875-A2 DIARYLSULFONE SULFONAMIDES AND USE THEROF WYETH (US) 2006-11-23 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-20060276464-A1 Diarylsulfone sulfonamides and use thereof SFRP1, SOS1, FZD7 MEN1 886/4885KMT2A 3832/4885NAMPT 3852/4885

“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.