SCHEMBL5960002

SCHEMBL5960002

Cc1cc(NS(=O)(=O)c2ccc(Cl)s2)ccc1NC(=O)OC(C)(C)C

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.53
LMNA P02545 6/20 0.53
ALDH1A1 P00352 6/20 0.53
SMN1; SMN2 Q16637 6/20 0.51
MEN1 O00255 7/20 0.47
KMT2A Q03164 7/20 0.47
HTT P42858 5/20 0.47
RECQL P46063 2/20 0.47
PABPC1 P11940 1/20 0.44
POLB P06746 1/20 0.44
NPC1 O15118 1/20 0.43
HPGD P15428 1/20 0.43
CASP3 P42574 1/20 0.43
SENP8 Q96LD8 1/20 0.43
SENP7 Q9BQF6 1/20 0.43
SENP6 Q9GZR1 1/20 0.43
PSEN1 P49768 1/20 0.42
PSEN2 P49810 1/20 0.42
APH1B Q8WW43 1/20 0.42
NCSTN Q92542 1/20 0.42

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
SCHEMBL1548554 0.89 FBP1 (0.43) MAPTLMNAALDH1A1SMN1; SMN2MEN1
SCHEMBL5960001 0.80 NPC1 (0.38) MAPTLMNAALDH1A1SMN1; SMN2MEN1
SCHEMBL7578134 0.77 LMNA (0.71) MAPTLMNAALDH1A1SMN1; SMN2MEN1
SCHEMBL28079459 0.75 PSEN1 (0.52) MAPTALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL7573143 0.75 ALDH1A1 (0.64) MAPTLMNAALDH1A1SMN1; SMN2MEN1
SCHEMBL15914448 0.74 KMT2A (0.47) MAPTSMN1; SMN2KMT2AHTTNPC1
SCHEMBL5960273 0.73 ALDH1A1 (0.62) MAPTLMNAALDH1A1SMN1; SMN2MEN1
SCHEMBL5731619 0.72 POLB (0.54) MAPTALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL8297312 0.70 SMN1; SMN2 (0.63) MAPTLMNAALDH1A1SMN1; SMN2MEN1
SCHEMBL29346029 0.69 CA12 (0.46) ALDH1A1SMN1; SMN2MEN1KMT2AHPGD

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-1412364-B1 PLATELET ADP RECEPTOR INHIBITORS PORTOLA PHARM INC (US) 2006-09-13 EP disclosed