Methenamine

Methenamine

SCHEMBL5801339

C1N2CN3CN1CN(C2)C3.CC(C)(C)OC(=O)NCC(=O)c1ccc(OCC(=O)O)cc1

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.48
NR1H4 Q96RI1 1/20 0.48
SMN1; SMN2 Q16637 2/20 0.45
ITGB3 P05106 2/20 0.44
ITGA2B P08514 2/20 0.44
CA12 O43570 5/20 0.40
CA1 P00915 5/20 0.40
CA2 P00918 5/20 0.40
CA9 Q16790 5/20 0.40
MAPT P10636 2/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
HDAC1 Q13547 1/20 0.39
NR4A1 P22736 1/20 0.39
APEX1 P27695 1/20 0.39
SIGMAR1 Q99720 1/20 0.38
HRH2 P25021 1/20 0.38
HRH1 P35367 1/20 0.38
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 1/20 0.38

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
SCHEMBL2009205 0.93 SMN1; SMN2 (0.51) EPHX2NR1H4SMN1; SMN2ITGB3ITGA2B
SCHEMBL3604860 0.79 RAB9A (0.49) SMN1; SMN2CA12CA1CA2CA9
SCHEMBL2013987 0.79 MAPT (0.49) EPHX2NR1H4SMN1; SMN2CA12CA1
SCHEMBL3608658 0.78 EPHX2 (0.62) EPHX2NR1H4SMN1; SMN2CA12CA1
SCHEMBL2009888 0.78 HDAC1 (0.55) SMN1; SMN2MAPTNPC1RAB9AHDAC1
SCHEMBL16215508 0.78 ALDH1A1 (0.55) EPHX2NR1H4CA12CA1CA2
SCHEMBL19331732 0.78 MAPT (0.51) EPHX2NR1H4SMN1; SMN2MAPTSIGMAR1
SCHEMBL750357 0.78 EPHX2 (0.58) EPHX2NR1H4SMN1; SMN2CA12CA1
SCHEMBL2013045 0.77 SMN1; SMN2 (0.49) SMN1; SMN2MAPTNPC1RAB9AHDAC1
SCHEMBL1668544 0.77 NR1H4 (0.76) EPHX2NR1H4SMN1; SMN2NPC1RAB9A

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-1677783-A2 FIBRINOGEN RECEPTOR ANTAGONISTS AND THEIR USE Nicholas Piramal India Limited (IN) 2006-07-12 EP disclosed
WO-2005035495-A2 FIBRINOGEN RECEPTOR ANTAGONISTS AND THEIR USE NICHOLAS PIRAMAL INDIA LIMITED (IN) 2005-04-21 WO disclosed