SCHEMBL6154334

SCHEMBL6154334

CCCCCCCCCC(CCCCC)OC(=O)N(C)c1ccccn1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.39
ALOX12 P18054 2/20 0.38
LIPE Q05469 1/20 0.37
PRSS1 P07477 1/20 0.37
PRSS2 P07478 1/20 0.37
PRSS3 P35030 1/20 0.37
HDAC3 O15379 1/20 0.36
HDAC4 P56524 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC2 Q92769 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
HDAC5 Q9UQL6 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C19 P33261 1/20 0.36
POLQ O75417 1/20 0.36
KDM4E B2RXH2 2/20 0.36
LMNA P02545 2/20 0.36
USP2 O75604 1/20 0.36
ALOX15 P16050 1/20 0.36
HTT P42858 1/20 0.36

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 0.78 NAAA (0.40) ALDH1A1HDAC3HDAC1HDAC2CYP1A2
SCHEMBL9124901 0.78 PRSS1 (0.35) PRSS1PRSS2PRSS3
SCHEMBL25081069 0.77 LIPE (0.47) LIPECYP2C19POLQLMNAHTT
SCHEMBL6157543 0.77 TRPV1 (0.53) ALDH1A1CYP1A2CYP2C19LMNAHTT
SCHEMBL28770588 0.75 KDM4E (0.47) ALDH1A1ALOX12PRSS1PRSS2PRSS3
SCHEMBL761922 0.75 ALOX15 (0.45) ALDH1A1LIPEHDAC3HDAC4HDAC1
SCHEMBL6154861 0.74 TLR2 (0.45) ALDH1A1ALOX12PRSS1PRSS2PRSS3
SCHEMBL16415718 0.74 LMNA (0.47) ALDH1A1LIPECYP2C19POLQKDM4E
SCHEMBL27701669 0.74 CHRNB2 (0.47) ALDH1A1PRSS1PRSS2PRSS3NPC1
SCHEMBL31403308 0.73 PRSS1 (0.37) ALDH1A1ALOX12PRSS1

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