SCHEMBL1440223

SCHEMBL1440223

CCOC(=O)C1CCN(c2nc3cc(C)c(C)cc3[nH]2)CC1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.52
▸ ALDH1A1 P00352 4/20 0.50
▸ LMNA P02545 3/20 0.50
▸ MEN1 O00255 2/20 0.50
▸ KMT2A Q03164 2/20 0.50
▸ KDM4E B2RXH2 2/20 0.50
▸ TP53 P04637 1/20 0.47
▸ POLB P06746 2/20 0.47
▸ RAB9A P51151 2/20 0.47
▸ NPC1 O15118 1/20 0.47
▸ TRPV1 Q8NER1 1/20 0.47
▸ MAPK1 P28482 2/20 0.46
▸ GAA P10253 1/20 0.46
▸ HPGD P15428 1/20 0.46
▸ TSHR P16473 1/20 0.46
▸ CASP1 P29466 1/20 0.46
▸ HTT P42858 1/20 0.46
▸ HSD17B10 Q99714 1/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ SHMT2 P34897 1/20 0.46

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
SCHEMBL12076349 0.92 MAPT (0.52) MAPTALDH1A1LMNAMEN1KMT2A
SCHEMBL1440241 0.91 MAPT (0.53) MAPTALDH1A1LMNAMEN1KMT2A
SCHEMBL1440354 0.91 MAPT (0.53) MAPTALDH1A1LMNAMEN1KMT2A
SCHEMBL1440521 0.89 MAPT (0.55) MAPTALDH1A1LMNAMEN1KMT2A
SCHEMBL1439951 0.84 MAPT (0.52) MAPTLMNAKDM4ETP53POLB
SCHEMBL15474490 0.84 MAPT (0.64) MAPTLMNAMEN1KMT2ATP53
SCHEMBL1440037 0.79 LMNA (0.63) MAPTLMNAKDM4ETP53POLB
SCHEMBL1440380 0.77 PTGES (0.58) MAPTALDH1A1LMNAKDM4ETP53
SCHEMBL1440776 0.75 MAPT (0.55) MAPTLMNAKDM4ETP53TRPV1
SCHEMBL1440170 0.75 MAPT (0.55) MAPTLMNAKDM4ETP53TRPV1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012117062-A1 PIPERIDINYL BENZOIMIDAZOLE DERIVATIVES AS MPGES-1 INIHIBITORS NOVASAID AB (SE) 2012-09-07 — — WO disclosed
WO-2012117062-A1 PIPERIDINYL BENZOIMIDAZOLE DERIVATIVES AS MPGES-1 INIHIBITORS NOVASAID AB (SE) 2012-09-07 — — WO disclosed
EP-2495244-A1 Piperidinyl benzoimidazole derivatives as mPGEs-1 inhibitors NovaSaid AB (SE) 2012-09-05 — — EP disclosed
EP-2495244-A1 Piperidinyl benzoimidazole derivatives as mPGEs-1 inhibitors NovaSaid AB (SE) 2012-09-05 — — EP disclosed
WO-2011023812-A1 MICROSOMAL PROSTAGLANDIN E SYNTHASE-1 (MPGES1) INHIBITORS NOVASAID AB (SE) 2011-03-03 — — WO disclosed
WO-2011023812-A1 MICROSOMAL PROSTAGLANDIN E SYNTHASE-1 (MPGES1) INHIBITORS NOVASAID AB (SE) 2011-03-03 — — WO disclosed
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