SCHEMBL7744404

SCHEMBL7744404

CC(C)(C)OC(=O)NC(C)(C)c1n[nH]c(=O)o1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ NPSR1 Q6W5P4 1/20 0.40
▸ EPHX2 P34913 3/20 0.38
▸ GAA P10253 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ GFER P55789 2/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ PSMB8 P28062 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ PTGS1 P23219 1/20 0.33
▸ HTT P42858 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ RORC P51449 1/20 0.32

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
SCHEMBL524005 0.72 NPSR1 (0.54) NPSR1EPHX2KDM4ELMNAGFER
SCHEMBL16630325 0.71 KMT2A (0.54) NPSR1EPHX2LMNAALDH1A1KMT2A
SCHEMBL14152198 0.70 GAA (0.35) NPSR1EPHX2GAAKDM4ELMNA
SCHEMBL16629746 0.69 LMNA (0.49) NPSR1EPHX2LMNAALDH1A1KMT2A
SCHEMBL14152565 0.67 CNR2 (0.43) GAAKMT2A
SCHEMBL38661956 0.66 RAB9A (0.45) NPSR1EPHX2GAAKDM4ELMNA
SCHEMBL17645696 0.66 MEN1 (0.33) GAAKMT2A
SCHEMBL29168097 0.66 RAB9A (0.38) NPSR1EPHX2GAAKDM4ELMNA
SCHEMBL4788987 0.65 APLNR (0.36) NPSR1GAAKDM4ELMNAGFER
SCHEMBL14152731 0.63 CNR2 (0.43) GAAKDM4ELMNAGFERALDH1A1

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-0918534-A4 PEPTIDYL PRODRUGS AND METHODS OF MAKING AND USING THE SAME UNIV PITTSBURGH (US) 2001-10-10 — — EP disclosed
EP-0918534-A1 PEPTIDYL PRODRUGS AND METHODS OF MAKING AND USING THE SAME UNIVERSITY OF PITTSBURGH OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 1999-06-02 — — EP disclosed
WO-1998004277-A1 PEPTIDYL PRODRUGS AND METHODS OF MAKING AND USING THE SAME UNIVERSITY OF PITTSBURGH OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 1998-02-05 — — WO disclosed
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