SCHEMBL7191979

SCHEMBL7191979

C[C@@H]1CN(C(=O)c2cc3c(N4CCCC4)nccc3o2)C[C@H](C)N1c1ccnc(CCO)n1

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ SORD Q00796 9/20 0.46
▸ RAB9A P51151 3/20 0.35
▸ NPC1 O15118 2/20 0.35
▸ PDE10A Q9Y233 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ DPP4 P27487 1/20 0.33
▸ DPP8 Q6V1X1 1/20 0.33
▸ MKNK1 Q9BUB5 4/20 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
SCHEMBL6782757 0.94 SORD (0.45) SORDRAB9ANPC1PDE10AMKNK1
SCHEMBL7186896 0.86 SORD (0.46) SORDRAB9ANPC1
SCHEMBL6294531 0.84 SORD (0.52) SORD
SCHEMBL7182215 0.82 SORD (0.47) SORDRAB9ANPC1
SCHEMBL6293149 0.78 SORD (0.50) SORD
SCHEMBL6293626 0.71 SORD (0.50) SORD
SCHEMBL7179704 0.71 SORD (0.80) SORD
SCHEMBL7177543 0.71 SORD (0.80) SORD
SCHEMBL7190501 0.70 SORD (0.47) SORDRAB9A
SCHEMBL6294660 0.70 SORD (0.53) 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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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
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
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
Send feedback