SCHEMBL9375481

SCHEMBL9375481

C=C(C)c1cccc(OCCOC(N)=O)c1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.49
PRSS1 P07477 9/20 0.48
F2 P00734 1/20 0.44
PLG P00747 1/20 0.44
PRSS2 P07478 1/20 0.44
C1S P09871 1/20 0.44
PRSS3 P35030 1/20 0.44
LMNA P02545 1/20 0.44
MAPK1 P28482 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
MAOB P27338 1/20 0.43
F10 P00742 2/20 0.43
SMPD1 P17405 1/20 0.43

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
SCHEMBL9374649 0.82 PARP10 (0.50) PRSS1LMNAMAPK1L3MBTL1
SCHEMBL28985986 0.81 L3MBTL1 (0.58) KMT2APRSS1F2PLGPRSS2
SCHEMBL24749935 0.80 KMT2A (0.47) KMT2APRSS1F2PLGPRSS2
SCHEMBL9448492 0.79 PARP1 (0.57) KMT2APRSS1F2PLGPRSS2
SCHEMBL8067261 0.79 ALDH1A1 (0.50) KMT2APRSS1F2PLGPRSS2
SCHEMBL22469033 0.77 TSHR (0.53) KMT2APRSS1LMNAMAOB
SCHEMBL5036731 0.77 KMT2A (0.55) KMT2APRSS1MAPK1SMPD1
SCHEMBL13185176 0.77 L3MBTL1 (0.60) KMT2ALMNAMAPK1L3MBTL1
SCHEMBL8060824 0.76 ALDH1A1 (0.53) KMT2ALMNAMAPK1L3MBTL1
SCHEMBL5974513 0.76 MAOB (0.68) KMT2AMAOB

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-0385457-B1 High surface hardness transparent resin and polymerizable monomer MITSUI TOATSU CHEMICALS (JP) 1994-06-01 EP disclosed
EP-0385457-A2 High surface hardness transparent resin and polymerizable monomer MITSUI TOATSU CHEMICALS, Inc. (JP) 1990-09-05 EP disclosed