SCHEMBL1670666

SCHEMBL1670666

O=C(CNC(=O)c1ccc2cccccc1-2)NC1CCCCC1

nearest known ligand 0.67

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.67
MEN1 O00255 4/20 0.67
ALDH1A1 P00352 3/20 0.67
SMN1; SMN2 Q16637 2/20 0.67
LMNA P02545 1/20 0.67
NPSR1 Q6W5P4 1/20 0.67
GAA P10253 1/20 0.65
EPHX2 P34913 1/20 0.51
RAB9A P51151 3/20 0.47
HPGD P15428 1/20 0.47
NPC1 O15118 2/20 0.47
CHRNB2 P17787 1/20 0.47
CHRNB4 P30926 1/20 0.47
CHRNA3 P32297 1/20 0.47
CHRNA4 P43681 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
SCHEMBL1945585 0.78 RAB9A (0.54) KMT2AMEN1ALDH1A1SMN1; SMN2LMNA
SCHEMBL16607158 0.78 KMT2A (0.67) KMT2AMEN1ALDH1A1SMN1; SMN2LMNA
SCHEMBL10131753 0.76 CCR2 (0.56) KMT2AMEN1ALDH1A1EPHX2RAB9A
SCHEMBL1670902 0.75 CHRNB2 (0.73) KMT2AMEN1ALDH1A1LMNANPSR1
SCHEMBL10337975 0.74 CHRNB2 (0.58) KMT2AALDH1A1LMNANPSR1GAA
SCHEMBL1670668 0.73 MEN1 (0.61) KMT2AMEN1ALDH1A1SMN1; SMN2LMNA
SCHEMBL1672799 0.73 TSHR (0.55) KMT2AMEN1ALDH1A1SMN1; SMN2LMNA
SCHEMBL516891 0.72 ALDH1A1 (0.82) KMT2AMEN1ALDH1A1SMN1; SMN2LMNA
SCHEMBL1649572 0.72 CHRNB2 (0.68) KMT2AALDH1A1LMNANPSR1GAA
SCHEMBL11007801 0.71 CHRNB2 (0.72) KMT2AMEN1ALDH1A1SMN1; SMN2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2385948-A1 FUSED THIAZOLO AND OXAZOLO PYRIMIDINONES Torrent Pharmaceuticals Limited (IN) 2011-11-16 EP disclosed
WO-2011045811-A1 FUSED THIAZOLO AND OXAZOLO PYRIMIDINONES TORRENT PHARMACEUTICALS LIMITED (IN) 2011-04-21 WO disclosed