SCHEMBL5455412

SCHEMBL5455412

O=C(O)c1ccccc1NC(=S)Nc1ccccc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.71
CA2 P00918 1/20 0.71
ALDH1A1 P00352 8/20 0.61
CYP3A4 P08684 1/20 0.61
TAS2R38 P59533 1/20 0.61
HSD17B10 Q99714 1/20 0.61
KDM4E B2RXH2 3/20 0.59
POLB P06746 1/20 0.59
MASP2 O00187 1/20 0.58
GAA P10253 5/20 0.58
LMNA P02545 2/20 0.58
KMT2A Q03164 2/20 0.57
MEN1 O00255 1/20 0.57
NPC1 O15118 1/20 0.57
RAB9A P51151 1/20 0.57
NOX1 Q9Y5S8 1/20 0.57
MAOA P21397 1/20 0.56
MAOB P27338 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
FABP4 P15090 1/20 0.56

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
SCHEMBL31212658 1.00 CA1 (0.71) CA1CA2ALDH1A1CYP3A4TAS2R38
SCHEMBL15398268 0.89 CA1 (0.67) CA1CA2ALDH1A1CYP3A4KDM4E
SCHEMBL11674075 0.86 GAA (0.62) CA1CA2ALDH1A1CYP3A4TAS2R38
SCHEMBL5129490 0.82 KDM4E (0.63) CA1CA2ALDH1A1KDM4EPOLB
SCHEMBL6432348 0.82 GRIK1 (0.77) ALDH1A1GAALMNAKMT2AMEN1
SCHEMBL31580808 0.81 KDM4E (0.71) CA2ALDH1A1HSD17B10KDM4EGAA
SCHEMBL1462332 0.81 KDM4E (0.71) CA2ALDH1A1HSD17B10KDM4EGAA
SCHEMBL11074391 0.79 CA1 (0.74) CA1ALDH1A1KDM4EGAALMNA
SCHEMBL132620 0.78 ALDH1A1 (1.00) ALDH1A1CYP3A4TAS2R38HSD17B10KDM4E
SCHEMBL3627546 0.78 MASP2 (0.62) CA1CA2ALDH1A1KDM4EPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1999029640-A2 COMPOSITIONS AND METHODS FOR MODULATING THE ACTIVITY OF FIBROBLAST GROWTH FACTOR EISAI CO., LTD. (JP) 1999-06-17 WO claimed
CN-101129295-B There is the binary initiator system of good storage stability and especially suitable for acidic system HERAEUS KULZER GMBH (DE) 2016-02-10 CN disclosed
CN-101129295-A 2-component initiator system (amine free) with storage stability and especially suitable for acidic systems HERAEUS KULZER GMBH (DE) 2008-02-27 CN disclosed
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
EP-1091958-A1 SALTS OF PAROXETINE SMITHKLINE BEECHAM PLC (GB) 2001-04-18 EP disclosed
WO-2000001692-A1 SALTS OF PAROXETINE SMITHKLINE BEECHAM PLC (GB) 2000-01-13 WO disclosed
WO-1999029640-A2 COMPOSITIONS AND METHODS FOR MODULATING THE ACTIVITY OF FIBROBLAST GROWTH FACTOR EISAI CO., LTD. (JP) 1999-06-17 WO disclosed
US-4048333-A Method for treating a picorna virus infection MEDIZINSKA AKADEMIA (BG) 1977-09-13 US disclosed