SCHEMBL6157543

SCHEMBL6157543

CCCCCCCCCC(CCCCC)OC(=O)N(C)c1cccnc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 3/20 0.53
LMNA P02545 5/20 0.44
NOTUM Q6P988 1/20 0.43
POLB P06746 2/20 0.41
MAPT P10636 3/20 0.40
NFKB1 P19838 2/20 0.40
NFKB2 Q00653 2/20 0.40
RELA Q04206 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
NPC1 O15118 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
KCNA5 P22460 1/20 0.39
KCNH2 Q12809 1/20 0.39
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.38
KMT2A Q03164 1/20 0.38
CYP2C9 P11712 2/20 0.38
CYP2C19 P33261 2/20 0.38
TDP1 Q9NUW8 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
SCHEMBL6155143 0.85 NAAA (0.40) TRPV1LMNAMAPTNFKB1NFKB2
SCHEMBL27701669 0.78 CHRNB2 (0.47) NPC1SMN1; SMN2MEN1ALDH1A1KMT2A
SCHEMBL27704256 0.77 NOTUM (0.48) TRPV1LMNANOTUMMAPTL3MBTL1
SCHEMBL6154334 0.77 ALDH1A1 (0.39) LMNANPC1SMN1; SMN2ALDH1A1CYP2C19
SCHEMBL28359033 0.76 LMNA (0.64) LMNAPOLBMAPTNFKB1NFKB2
SCHEMBL26957589 0.75 NOTUM (0.51) TRPV1LMNANOTUML3MBTL1SMN1; SMN2
SCHEMBL27921411 0.74 NOTUM (0.58) TRPV1LMNANOTUMMAPTL3MBTL1
SCHEMBL6157034 0.73 TDP1 (0.54) TRPV1LMNAPOLBL3MBTL1TDP1
SCHEMBL28914950 0.72 LMNA (0.62) LMNAPOLBMAPTNFKB1NFKB2
SCHEMBL6157548 0.72 FAAH (0.56) TRPV1LMNAMAPTALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1499326-A1 OXOLIDE ANTIBACTERIALS Abbott Laboratories (US) 2005-01-26 EP claimed
WO-2003090760-A1 OXOLIDE ANTIBACTERIALS ABBOTT LABORATORIES (US) 2003-11-06 WO claimed
EP-1499326-A1 OXOLIDE ANTIBACTERIALS Abbott Laboratories (US) 2005-01-26 EP disclosed
WO-2003090760-A1 OXOLIDE ANTIBACTERIALS ABBOTT LABORATORIES (US) 2003-11-06 WO disclosed