SCHEMBL6027790

SCHEMBL6027790

CCNC(=O)Oc1ccc(-c2ccccc2)cn1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.50
RAB9A P51151 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
HIF1A Q16665 3/20 0.46
LMNA P02545 1/20 0.44
PKM P14618 1/20 0.44
HDAC3 O15379 1/20 0.43
HDAC4 P56524 1/20 0.43
HDAC1 Q13547 1/20 0.43
HDAC7 Q8WUI4 1/20 0.43
HDAC2 Q92769 1/20 0.43
HDAC10 Q969S8 1/20 0.43
HDAC11 Q96DB2 1/20 0.43
HDAC8 Q9BY41 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
HDAC9 Q9UKV0 1/20 0.43
HDAC5 Q9UQL6 1/20 0.43
DGAT1 O75907 1/20 0.43
GABRA5 P31644 1/20 0.42
GSK3A P49840 1/20 0.42

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
SCHEMBL6027578 0.85 NPC1 (0.49) NPC1RAB9ASMN1; SMN2HDAC3HDAC4
SCHEMBL10133070 0.84 HIF1A (0.51) HIF1ALMNAGSK3AGSK3B
SCHEMBL11118691 0.81 ALDH1A1 (0.48) HIF1A
SCHEMBL11114904 0.79 MKNK1 (0.49) NPC1HIF1ALMNAPKMDGAT1
SCHEMBL5702341 0.79 RAB9A (0.62) NPC1RAB9ASMN1; SMN2HDAC3HDAC4
SCHEMBL4709392 0.78 MKNK1 (0.46) NPC1RAB9ASMN1; SMN2HIF1ALMNA
SCHEMBL28522946 0.77 KDM4E (0.46) NPC1RAB9ASMN1; SMN2LMNAPKM
SCHEMBL21409871 0.77 CHRM4 (0.44) NPC1RAB9ALMNAPKMHDAC1
SCHEMBL11114742 0.76 ACHE (0.51) KMT2A
SCHEMBL6027500 0.75 SMN1; SMN2 (0.48) NPC1RAB9ASMN1; SMN2LMNAKMT2A

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-1720829-A1 DERIVATIVES OF HETEROARYL-ALKYLCARBAMATES, PREPARATION METHOD THEREOF AND USE OF SAME AS FAAH ENZYME INHIBITORS Sanofi-Aventis (FR) 2006-11-15 EP disclosed
WO-2005090292-A1 DERIVATIVES OF HETEROARYL-ALKYLCARBAMATES, PREPARATION METHOD THEREOF AND USE OF SAME AS FAAH ENZYME INHIBITORS SANOFI-AVENTIS (FR) 2005-09-29 WO disclosed