SCHEMBL7862880

SCHEMBL7862880

CCCCN(CCCC)C(=O)c1cccc(S(=O)(=O)NC(=O)c2ccc(OC(=O)NCCO)nc2)c1

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
P4HTM Q9NXG6 3/20 0.37
BCL2L1 Q07817 3/20 0.36
BCL2 P10415 2/20 0.36
FBP1 P09467 1/20 0.36
MCL1 Q07820 1/20 0.36
ALDH1A1 P00352 2/20 0.36
HPGD P15428 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
NTRK2 Q16620 1/20 0.35
LIMK1 P53667 1/20 0.35
LIMK2 P53671 1/20 0.35
CYP2C19 P33261 1/20 0.35
HSD17B10 Q99714 1/20 0.35
TLR8 Q9NR97 1/20 0.34

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
SCHEMBL7867702 0.93 BCL2L1 (0.37) P4HTMBCL2L1BCL2FBP1MCL1
SCHEMBL7871612 0.91 LIMK1 (0.41) P4HTMALDH1A1HDAC1HDAC6NTRK2
SCHEMBL7867848 0.88 SMN1; SMN2 (0.45) P4HTMBCL2L1FBP1MCL1ALDH1A1
SCHEMBL9017993 0.87 BCL2L1 (0.40) P4HTMBCL2L1BCL2MCL1ALDH1A1
SCHEMBL8868129 0.87 P4HTM (0.45) P4HTMBCL2L1BCL2FBP1MCL1
SCHEMBL7869413 0.87 SMPD1 (0.45) FBP1HSD17B10
SCHEMBL7874547 0.85 SMN1; SMN2 (0.43) P4HTMBCL2L1MCL1HDAC6CYP2C19
SCHEMBL9018144 0.85 BCL2L1 (0.39) P4HTMBCL2L1BCL2MCL1ALDH1A1
SCHEMBL9018366 0.84 P4HTM (0.37) P4HTMBCL2L1BCL2MCL1ALDH1A1
SCHEMBL9018102 0.84 BCL2L1 (0.38) P4HTMBCL2L1BCL2MCL1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0562512-B1 Sulfonamidocarbonylpyridine-2-carboxamides and their use as medicines HOECHST AG (DE) 2001-02-21 EP disclosed