SCHEMBL459849

SCHEMBL459849

CCOc1ccccc1C=CC(=O)NNCN

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 4/20 0.53
▸ MAPT P10636 1/20 0.53
▸ ATM Q13315 1/20 0.53
▸ SMN1; SMN2 Q16637 1/20 0.53
▸ NPC1 O15118 1/20 0.49
▸ AR P10275 1/20 0.48
▸ EGFR P00533 1/20 0.48
▸ NFE2L2 Q16236 1/20 0.47
▸ MCL1 Q07820 1/20 0.46
▸ PTGES2 Q9H7Z7 1/20 0.46
▸ KDM4E B2RXH2 3/20 0.45
▸ MEN1 O00255 2/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ CYP1A2 P05177 1/20 0.45
▸ CYP2C9 P11712 1/20 0.45
▸ HDAC3 O15379 2/20 0.45
▸ HDAC4 P56524 2/20 0.45
▸ HDAC1 Q13547 2/20 0.45
▸ HDAC7 Q8WUI4 2/20 0.45
▸ HDAC2 Q92769 2/20 0.45

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
SCHEMBL458059 0.83 LMNA (0.58) LMNAMAPTATMSMN1; SMN2NPC1
SCHEMBL458060 0.83 LMNA (0.58) LMNAMAPTATMSMN1; SMN2NPC1
SCHEMBL15053445 0.83 LMNA (0.52) LMNAMAPTATMSMN1; SMN2NPC1
SCHEMBL5434722 0.81 LMNA (0.55) LMNAMAPTATMSMN1; SMN2NPC1
SCHEMBL5434717 0.81 LMNA (0.55) LMNAMAPTATMSMN1; SMN2NPC1
SCHEMBL30071741 0.81 LMNA (0.55) LMNAMAPTATMSMN1; SMN2NPC1
SCHEMBL28300287 0.79 LMNA (0.62) LMNAMAPTATMSMN1; SMN2NPC1
SCHEMBL20446704 0.79 LMNA (0.62) LMNAMAPTATMSMN1; SMN2NPC1
SCHEMBL27681869 0.78 LMNA (0.55) LMNAMAPTATMSMN1; SMN2NPC1
SCHEMBL27681870 0.78 LMNA (0.55) LMNAMAPTATMSMN1; SMN2NPC1

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-2614046-B1 NOVEL GUANIDINE DERIVATIVES IN THE CINNAMIC SERIES PROD CHIM AUXILIAIRES ET DE SYNTHESE (FR) 2014-08-20 — — EP disclosed
EP-2614046-A1 NOVEL GUANIDINE DERIVATIVES IN THE CINNAMIC SERIES Produits Chimiques Auxiliaires et de Synthese (FR) 2013-07-17 — — EP disclosed
WO-2012032257-A1 NOVEL GUANIDINE DERIVATIVES IN THE CINNAMIC SERIES PRODUITS CHIMIQUES AUXILIAIRES ET DE SYNTHESE (FR) 2012-03-15 — — WO disclosed
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