SCHEMBL14640402

SCHEMBL14640402

CCOC(=O)N/N=C(\C)c1cccc(Cn2sc(Cl)cc2=O)c1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.50
KAT2B Q92831 8/20 0.45
SMN1; SMN2 Q16637 2/20 0.44
PKM P14618 1/20 0.44
HPGD P15428 1/20 0.44
MAPT P10636 3/20 0.42
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2C19 P33261 1/20 0.39
ALDH1A1 P00352 1/20 0.37
RAB9A P51151 1/20 0.36
KDM4E B2RXH2 1/20 0.36
GAA P10253 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
SCHEMBL5917409 1.00 LMNA (0.50) LMNAKAT2BSMN1; SMN2PKMHPGD
SCHEMBL5917410 1.00 LMNA (0.50) LMNAKAT2BSMN1; SMN2PKMHPGD
SCHEMBL5593840 0.79 KAT2B (0.49) LMNAKAT2BSMN1; SMN2HPGDMEN1
SCHEMBL5593916 0.78 KAT2B (0.47) KAT2BHPGDMAPTMEN1KMT2A
SCHEMBL14640439 0.74 KAT2B (0.46) KAT2BPKMHPGDMAPTMEN1
SCHEMBL8740128 0.69 KMT2A (0.70) LMNASMN1; SMN2PKMHPGDMAPT
SCHEMBL8740131 0.69 KMT2A (0.70) LMNASMN1; SMN2PKMHPGDMAPT
SCHEMBL8682896 0.69 LMNA (0.60) LMNASMN1; SMN2PKMHPGDMAPT
SCHEMBL23241905 0.65 MAPT (0.61) LMNASMN1; SMN2PKMHPGDMAPT
SCHEMBL15354265 0.65 MAPT (0.61) LMNASMN1; SMN2PKMHPGDMAPT

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
WO-2007001932-A2 SUBSTITUTED ISOTHIAZOLONES AS INHIBITORS OF CYTOSOLIC PHOSPHOLIPASE A2 JANSSEN PHARMACEUTICA N.V. (BE) 2007-01-04 WO disclosed