SCHEMBL5258097

SCHEMBL5258097

Cc1cn(C(=O)NCCSCCCCl)nc1C(=O)Nc1ccc(F)cc1Cl

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 13/20 0.51
LMNA P02545 1/20 0.41
POLB P06746 1/20 0.38
MAPT P10636 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
TDP1 Q9NUW8 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 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
SCHEMBL5254653 0.84 ALOX15 (0.55) ALOX15LMNAPOLBMAPTSMN1; SMN2
SCHEMBL3989236 0.69 ALOX15 (0.94) ALOX15LMNANPC1RAB9A
SCHEMBL2907641 0.68 ALOX15 (1.00) ALOX15LMNANPC1RAB9A
SCHEMBL2909325 0.67 ALOX15 (1.00) ALOX15LMNANPC1
SCHEMBL31453202 0.65 ALOX15 (0.57) ALOX15LMNAMAPTSMN1; SMN2TDP1
SCHEMBL22939286 0.64 ALOX15 (0.57) ALOX15LMNAMAPT
SCHEMBL22257199 0.63 ALOX15 (0.55) ALOX15LMNA
SCHEMBL22257202 0.63 ALOX15 (0.55) ALOX15LMNA
SCHEMBL22257174 0.63 ALOX15 (0.50) ALOX15LMNAMAPT
SCHEMBL25959661 0.62 ALOX15 (0.47) ALOX15LMNAMAPTSMN1; SMN2

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-1794130-A1 PYRAZOLE COMPOUNDS USEFUL IN THE TREATMENT OF INFLAMMATION Biolipox AB (SE) 2007-06-13 EP disclosed
WO-2006032852-A1 PYRAZOLE COMPOUNDS USEFUL UIN THE TREATMENT OF INFLAMMATION BIOLIPOX AB (SE) 2006-03-30 WO disclosed