SCHEMBL5717320

SCHEMBL5717320

CCC/N=C1/NC(=O)CS1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.75
LMNA P02545 1/20 0.75
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49
CA4 P22748 1/20 0.49
CA7 P43166 1/20 0.49
TDP1 Q9NUW8 3/20 0.46
MAPT P10636 3/20 0.45
HPGD P15428 3/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
GAA P10253 2/20 0.45
POLB P06746 1/20 0.45
MAPK1 P28482 1/20 0.45
RECQL P46063 1/20 0.45
BLM P54132 1/20 0.45
HSD17B10 Q99714 1/20 0.45
ALDH1A1 P00352 6/20 0.43
USP2 O75604 1/20 0.42
ALOX15 P16050 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
SCHEMBL5717324 1.00 KDM4E (0.75) KDM4ELMNACA1CA2CA4
SCHEMBL2593144 0.87 KDM4E (0.97) KDM4ELMNACA1CA2CA4
SCHEMBL7187532 0.87 KDM4E (0.97) KDM4ELMNACA1CA2CA4
SCHEMBL3432608 0.86 KDM4E (1.00) KDM4ELMNACA1CA2CA4
SCHEMBL5717407 0.84
SCHEMBL16178828 0.72 KDM4E (0.71) KDM4ELMNACA1CA2CA4
SCHEMBL27285464 0.69 MAPT (0.50) KDM4ELMNATDP1MAPTHPGD
SCHEMBL10661961 0.69
SCHEMBL9174376 0.69
SCHEMBL5717201 0.68 TDP1 (0.58) KDM4ELMNATDP1MAPTHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1689726-A1 5-(BENZ- (Z) -YLIDENE) -THIAZOLIDIN-4-ONE DERIVATIVES AS IMMUNOSUPPRESSANT AGENTS Actelion Pharmaceuticals Ltd. (CH) 2006-08-16 EP claimed
WO-2005054215-A1 5-(BENZ- (Z) -YLIDENE) -THIAZOLIDIN-4-ONE DERIVATIVES AS IMMUNOSUPPRESSANT AGENTS ACTELION PHARMACEUTICALS LTD (CH) 2005-06-16 WO claimed
EP-1689726-A1 5-(BENZ- (Z) -YLIDENE) -THIAZOLIDIN-4-ONE DERIVATIVES AS IMMUNOSUPPRESSANT AGENTS Actelion Pharmaceuticals Ltd. (CH) 2006-08-16 EP disclosed
WO-2005054215-A1 5-(BENZ- (Z) -YLIDENE) -THIAZOLIDIN-4-ONE DERIVATIVES AS IMMUNOSUPPRESSANT AGENTS ACTELION PHARMACEUTICALS LTD (CH) 2005-06-16 WO disclosed