SCHEMBL8916941

SCHEMBL8916941

S=CNCCCc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 9/20 0.59
KMT2A Q03164 2/20 0.53
MEN1 O00255 1/20 0.53
L3MBTL1 Q9Y468 2/20 0.48
HPGD P15428 1/20 0.47
POLB P06746 1/20 0.47

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
SCHEMBL1270018 0.94 SIGMAR1 (0.59) SIGMAR1KMT2AMEN1L3MBTL1
SCHEMBL7963483 0.87 NPC1 (0.52) SIGMAR1L3MBTL1
SCHEMBL1356645 0.79 SIGMAR1 (0.65) SIGMAR1KMT2AMEN1L3MBTL1
SCHEMBL19711877 0.79 SIGMAR1 (0.59) SIGMAR1KMT2AMEN1L3MBTL1HPGD
SCHEMBL6014354 0.78 SIGMAR1 (0.57) SIGMAR1KMT2AMEN1L3MBTL1HPGD
Hydrochloric Acid SCHEMBL2493107 0.78 SIGMAR1 (0.57) SIGMAR1KMT2AMEN1L3MBTL1HPGD
SCHEMBL10937019 0.76 SIGMAR1 (0.55) SIGMAR1KMT2AMEN1L3MBTL1POLB
SCHEMBL1270023 0.75 SIGMAR1 (0.67) SIGMAR1KMT2AMEN1L3MBTL1
SCHEMBL10395208 0.75 SIGMAR1 (0.73) SIGMAR1KMT2AMEN1L3MBTL1HPGD
SCHEMBL8763261 0.75 TAAR1 (0.38) SIGMAR1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5616581-A BACTERICIDES YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1997-04-01 US disclosed
US-5504082-A BACTERICIDE FOR HELICOBACTER, ANTIULCER AGENT, GASTRIC ACIDSUPPRESSOR YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1996-04-02 US disclosed
EP-0644191-A1 PYRIDINE COMPOUND AND MEDICINAL USE THEREOF YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1995-03-22 EP disclosed