SCHEMBL2927049

SCHEMBL2927049

O=C(O)c1cc(N2CCCCC2)nc(-c2ccccc2)n1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.67
MAPT P10636 3/20 0.55
TSHR P16473 5/20 0.55
HSD17B10 Q99714 4/20 0.55
LMNA P02545 3/20 0.55
MAPK1 P28482 2/20 0.55
KDM4E B2RXH2 2/20 0.55
POLB P06746 2/20 0.54
ALDH1A1 P00352 6/20 0.53
HTT P42858 4/20 0.53
TDP1 Q9NUW8 2/20 0.53
KMT2A Q03164 1/20 0.53
CYP1A2 P05177 1/20 0.51
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51
L3MBTL1 Q9Y468 2/20 0.50
P2RY12 Q9H244 1/20 0.50
USP2 O75604 2/20 0.49
NPSR1 Q6W5P4 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.48

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
SCHEMBL6394883 0.97 HPGD (0.63) HPGDMAPTTSHRHSD17B10LMNA
SCHEMBL981752 0.86 HTT (0.74) HPGDMAPTTSHRHSD17B10LMNA
SCHEMBL2902905 0.86 HTT (0.54) HPGDMAPTTSHRHSD17B10LMNA
SCHEMBL6395632 0.83 MAPT (0.57) HPGDMAPTTSHRHSD17B10LMNA
SCHEMBL13309949 0.80 HPGD (1.00) HPGDMAPTTSHRHSD17B10LMNA
SCHEMBL19072152 0.80 SCN9A (0.63) KMT2ACYP1A2CYP2C9CYP2C19L3MBTL1
SCHEMBL2185490 0.79 KDM4E (0.49) HPGDMAPTTSHRHSD17B10MAPK1
SCHEMBL26070211 0.79 LMNA (0.78) HPGDMAPTTSHRHSD17B10LMNA
SCHEMBL981610 0.78 P2RY12 (0.56) HPGDMAPTTSHRHSD17B10LMNA
SCHEMBL13111332 0.78 HPGD (0.72) HPGDMAPTTSHRHSD17B10LMNA

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-2217606-A1 SOLUBILIZED THIAZOLOPYRIDINES Sirtris Pharmaceuticals, Inc. (US) 2010-08-18 EP disclosed
WO-2009061453-A1 SOLUBILIZED THIAZOLOPYRIDINES SIRTRIS PHARMACEUTICALS, INC. (US) 2009-05-14 WO disclosed