SCHEMBL5455860

SCHEMBL5455860

CCCNC(=S)Nc1ccc(O)cc1

nearest known ligand 0.72

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.72
CYP2C9 P11712 1/20 0.72
CYP2C19 P33261 1/20 0.72
KMT2A Q03164 6/20 0.71
MAPT P10636 7/20 0.68
GAA P10253 6/20 0.68
ALOX12 P18054 2/20 0.68
ALDH1A1 P00352 5/20 0.61
KDM4E B2RXH2 1/20 0.61
THRB P10828 1/20 0.61
L3MBTL1 Q9Y468 1/20 0.61
LMNA P02545 7/20 0.58
SMN1; SMN2 Q16637 3/20 0.58
HTT P42858 5/20 0.54
MEN1 O00255 2/20 0.54
MAOA P21397 1/20 0.53
MAOB P27338 1/20 0.53
NPSR1 Q6W5P4 1/20 0.51

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
SCHEMBL8439501 0.86 LMNA (0.65) CYP1A2CYP2C9CYP2C19KMT2AMAPT
SCHEMBL8439096 0.86 LMNA (0.65) CYP1A2CYP2C9CYP2C19KMT2AMAPT
SCHEMBL8442878 0.86 LMNA (0.65) CYP1A2CYP2C9CYP2C19KMT2AMAPT
SCHEMBL8443341 0.86 LMNA (0.65) CYP1A2CYP2C9CYP2C19KMT2AMAPT
SCHEMBL8440594 0.86 LMNA (0.65) CYP1A2CYP2C9CYP2C19KMT2AMAPT
SCHEMBL8391699 0.86 LMNA (0.65) CYP1A2CYP2C9CYP2C19KMT2AMAPT
SCHEMBL8438232 0.86 LMNA (0.65) CYP1A2CYP2C9CYP2C19KMT2AMAPT
SCHEMBL1872089 0.86 LMNA (0.65) CYP1A2CYP2C9CYP2C19KMT2AMAPT
SCHEMBL8443237 0.86 LMNA (0.65) CYP1A2CYP2C9CYP2C19KMT2AMAPT
SCHEMBL8441562 0.86 LMNA (0.65) CYP1A2CYP2C9CYP2C19KMT2AMAPT

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
US-20070040151-A1 Two-component initiator system (amine-free) with very good storage stability and particular suitability for acid systems HERAEUS KULZER GMBH (DE) 2007-02-22 US disclosed