SCHEMBL7178987

SCHEMBL7178987

C[C@@H]1CN(c2ccnc(CCO)n2)C[C@H](C)N1C(=O)Oc1cccnc1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ SORD Q00796 10/20 0.49
▸ CCNC P24863 1/20 0.36
▸ CDK8 P49336 1/20 0.36
▸ KMT2A Q03164 1/20 0.35
▸ OGA O60502 1/20 0.35
▸ JAK2 O60674 2/20 0.34
▸ JAK1 P23458 2/20 0.34
▸ TYK2 P29597 2/20 0.34
▸ EIF2AK4 Q9P2K8 2/20 0.34

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
SCHEMBL7567364 0.89 SORD (0.50) SORDKMT2AJAK2JAK1TYK2
SCHEMBL7572046 0.86 KMT2A (0.39) SORDCCNCCDK8KMT2AJAK2
SCHEMBL7571577 0.83 SORD (0.49) SORD
SCHEMBL6294428 0.82 SORD (0.56) SORD
SCHEMBL7184150 0.81 SORD (0.60) SORDEIF2AK4
SCHEMBL6297892 0.77 SORD (0.40) SORDCCNCCDK8KMT2A
SCHEMBL7179704 0.74 SORD (0.80) SORD
SCHEMBL7190501 0.73 SORD (0.47) SORDJAK2JAK1TYK2EIF2AK4
SCHEMBL6294544 0.71 SORD (0.57) SORD
SCHEMBL7185492 0.70 SORD (0.78) SORD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1337271-A2 COMBINATION OF GABA AGONISTS AND SORBITOL DEHYDROGENASE INHIBITORS Pfizer Products Inc. (US) 2003-08-27 — — EP claimed
EP-1326591-A2 COMBINATION OF STATINS AND SORBITOL DEHYDROGENASE INHIBITORS Pfizer Products Inc. (US) 2003-07-16 — — EP claimed
WO-2002098429-A1 ETHANOLAMINE, DIETHANOLAMINE OR TRIETHANOLAMINE SALT OF ZOPOLRESTAT PFIZER PRODUCTS INC. (US) 2002-12-12 — — WO claimed
WO-2002043762-A2 COMBINATION OF GABA AGONISTS AND SORBITOL DEHYDROGENASE INHIBITORS PFIZER PRODUCTS INC. (US) 2002-06-06 — — WO claimed
WO-2002032411-A2 COMBINATION OF STATINS AND SORBITOL DEHYDROGENASE INHIBITORS PFIZER PRODUCTS INC. (US) 2002-04-25 — — WO claimed
EP-1185275-A1 AMINOPYRIMIDINES AS SORBITOL DEHYDROGENASE INHIBITORS Pfizer Products Inc. (US) 2002-03-13 — — EP claimed
WO-2000059510-A1 AMINOPYRIMIDINES AS SORBITOL DEHYDROGENASE INHIBITORS PFIZER PRODUCTS INC. (US) 2000-10-12 — — WO claimed
EP-1337271-A2 COMBINATION OF GABA AGONISTS AND SORBITOL DEHYDROGENASE INHIBITORS Pfizer Products Inc. (US) 2003-08-27 — — EP disclosed
EP-1326591-A2 COMBINATION OF STATINS AND SORBITOL DEHYDROGENASE INHIBITORS Pfizer Products Inc. (US) 2003-07-16 — — EP disclosed
WO-2002098429-A1 ETHANOLAMINE, DIETHANOLAMINE OR TRIETHANOLAMINE SALT OF ZOPOLRESTAT PFIZER PRODUCTS INC. (US) 2002-12-12 — — WO disclosed
WO-2002043762-A2 COMBINATION OF GABA AGONISTS AND SORBITOL DEHYDROGENASE INHIBITORS PFIZER PRODUCTS INC. (US) 2002-06-06 — — WO disclosed
WO-2002032411-A2 COMBINATION OF STATINS AND SORBITOL DEHYDROGENASE INHIBITORS PFIZER PRODUCTS INC. (US) 2002-04-25 — — WO disclosed
EP-1185275-A1 AMINOPYRIMIDINES AS SORBITOL DEHYDROGENASE INHIBITORS Pfizer Products Inc. (US) 2002-03-13 — — EP disclosed
WO-2000059510-A1 AMINOPYRIMIDINES AS SORBITOL DEHYDROGENASE INHIBITORS PFIZER PRODUCTS INC. (US) 2000-10-12 — — WO disclosed
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