SCHEMBL16692249

SCHEMBL16692249

CC(C)(C)OC(=O)Nc1n[nH]c2cnccc12

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 3/20 0.48
▸ NAMPT P43490 1/20 0.43
▸ CYP17A1 P05093 2/20 0.41
▸ GSK3B P49841 4/20 0.41
▸ LATS1 O95835 6/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ LATS2 Q9NRM7 1/20 0.40
▸ DYRK1A Q13627 2/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ CHUK O15111 1/20 0.38

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
SCHEMBL19100555 0.82 MAPK1 (0.53) MAPK1GSK3BCYP1A2DYRK1ARAB9A
SCHEMBL15081348 0.76 MAPK1 (0.46) MAPK1GSK3BCYP1A2DYRK1A
SCHEMBL1141943 0.75 MAPK1 (0.48) MAPK1GSK3BCYP1A2DYRK1A
SCHEMBL3712153 0.73 MAPK1 (0.46) MAPK1GSK3BCYP1A2DYRK1A
SCHEMBL25945842 0.73 LATS1 (0.42) MAPK1GSK3BLATS1CYP1A2LATS2
SCHEMBL13759613 0.72 ATR (0.42) MAPK1NAMPTCYP17A1RAB9A
SCHEMBL14884375 0.72 JAK1 (0.48) NAMPTDYRK1A
SCHEMBL15081339 0.72 CDK2 (0.58) MAPK1GSK3BCYP1A2RAB9A
SCHEMBL18522430 0.71 NAMPT (0.50) NAMPTCYP17A1LATS1RAB9A
SCHEMBL3361949 0.70 MAPK1 (0.43) MAPK1CYP17A1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2927233-A1 INHIBITORS OF SEMICARBAZIDE-SENSITIVE AMINE OXIDASE Proximagen Limited (GB) 2015-10-07 — — EP disclosed
EP-2547677-B1 INHIBITORS OF SEMICARBAZIDE-SENSITIVE AMINE OXIDASE PROXIMAGEN LTD (GB) 2015-05-06 — — EP disclosed
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