SCHEMBL3463008

SCHEMBL3463008

COc1cc(CNc2nc3ccccc3o2)ccc1OCc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MRGPRX1 Q96LB2 3/20 0.52
LMNA P02545 1/20 0.52
F2 P00734 1/20 0.52
F10 P00742 1/20 0.52
PRSS1 P07477 1/20 0.52
F7 P08709 1/20 0.52
KMT2A Q03164 5/20 0.52
MEN1 O00255 4/20 0.52
SMN1; SMN2 Q16637 4/20 0.52
L3MBTL1 Q9Y468 2/20 0.52
MAPT P10636 2/20 0.51
KDM4E B2RXH2 1/20 0.51
ALDH1A1 P00352 1/20 0.51
TP53 P04637 1/20 0.51
GAA P10253 1/20 0.51
ALOX12 P18054 1/20 0.51
MAPK1 P28482 1/20 0.51
BCHE P06276 2/20 0.50
SSTR5 P35346 1/20 0.50
NPC1 O15118 3/20 0.49

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
SCHEMBL3463524 0.87 MAPT (0.55) KMT2AMEN1SMN1; SMN2L3MBTL1MAPT
SCHEMBL4686919 0.77 MEN1 (0.54) LMNAKMT2AMEN1SMN1; SMN2L3MBTL1
SCHEMBL31192466 0.77 MRGPRX1 (0.74) MRGPRX1LMNAF2F10PRSS1
SCHEMBL2676462 0.77 ELANE (0.65) KMT2ASMN1; SMN2ALDH1A1GAABCHE
SCHEMBL3463497 0.76 NPC1 (0.81) MRGPRX1LMNAF2F10PRSS1
SCHEMBL28659168 0.75 LMNA (0.61) MRGPRX1LMNAF2F10PRSS1
SCHEMBL5525095 0.74 BCHE (0.64) MRGPRX1LMNAF2F10PRSS1
SCHEMBL3051565 0.74 LMNA (0.74) MRGPRX1LMNAF2F10PRSS1
SCHEMBL6090056 0.74 ELANE (0.49) LMNAKMT2AMEN1SMN1; SMN2MAPT
SCHEMBL9416614 0.73 LMNA (0.73) MRGPRX1LMNAF2F10PRSS1

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
WO-2010010435-A2 FUSED OXAZOLE AND THIAZOLE DERIVATIVES AS TRPMS MODULATORS GLENMARK PHARMACEUTICAL S.A. (CH) 2010-01-28 WO disclosed
WO-2010010435-A2 FUSED OXAZOLE AND THIAZOLE DERIVATIVES AS TRPMS MODULATORS GLENMARK PHARMACEUTICAL S.A. (CH) 2010-01-28 WO disclosed