SCHEMBL7568696

SCHEMBL7568696

NC(=O)CCC(=O)N(CCCO)CCCO

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NTRK2 Q16620 1/20 0.35
LMNA P02545 1/20 0.33
ALDH1A1 P00352 2/20 0.32
HPGD P15428 1/20 0.32
CAMK2A Q9UQM7 1/20 0.32
HDAC1 Q13547 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
GPR84 Q9NQS5 1/20 0.30
FFAR1 O14842 1/20 0.30
FFAR4 Q5NUL3 1/20 0.30

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
SCHEMBL7564703 0.91 LMNA (0.38) NTRK2LMNAALDH1A1HPGDCAMK2A
SCHEMBL2187374 0.86 ALDH1A1 (0.34) LMNAALDH1A1HPGD
SCHEMBL19091931 0.83 LMNA (0.36) LMNAALDH1A1HPGDHDAC1HDAC6
SCHEMBL29094365 0.81 NTRK2 (0.39) NTRK2LMNAALDH1A1HPGDCAMK2A
SCHEMBL17291895 0.81 LMNA (0.44) NTRK2LMNAALDH1A1HPGDCAMK2A
SCHEMBL20561925 0.81 ACHE (0.39) LMNAALDH1A1HDAC1HDAC6
SCHEMBL1032662 0.81 MMP1 (0.48) LMNAALDH1A1HPGDHDAC1HDAC6
SCHEMBL1905343 0.80 LMNA (0.39) LMNAALDH1A1HPGDGPR84FFAR1
SCHEMBL28840611 0.79 KDM4A (0.41) LMNAALDH1A1HPGD
SCHEMBL2149157 0.78 LMNA (0.38) LMNAALDH1A1HPGDGPR84FFAR1

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-1230026-A1 ION EXCHANGE RESINS AND METHODS OF MAKING THE SAME BASF AKTIENGESELLSCHAFT (DE) 2002-08-14 EP disclosed
WO-2001030495-A1 ION EXCHANGE RESINS AND METHODS OF MAKING THE SAME BASF AKTIENGESELLSCHAFT (DE) 2001-05-03 WO disclosed