SCHEMBL3107041

SCHEMBL3107041

CC(=CN1CCNCC1)C(N)=O

nearest known ligand 0.33

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.33
KMT2A Q03164 2/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA9 Q16790 1/20 0.33
KDM4E B2RXH2 1/20 0.33
CHKA P35790 1/20 0.32
SIGMAR1 Q99720 1/20 0.32
CHRNB2 P17787 1/20 0.31
CHRNA3 P32297 1/20 0.31
CHRNA4 P43681 1/20 0.31
CHRNB3 Q05901 1/20 0.31
CHRNA6 Q15825 1/20 0.31
HTR2A P28223 1/20 0.31
HTR2C P28335 1/20 0.31
OPRD1 P41143 2/20 0.31
CHRM5 P08912 1/20 0.30
CHRM3 P20309 1/20 0.30

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
SCHEMBL1696446 0.85 TDP1 (0.33)
SCHEMBL6853283 0.83 TDP1 (0.32)
SCHEMBL5145532 0.83 TDP1 (0.32)
SCHEMBL489074 0.81 L3MBTL1 (0.34)
SCHEMBL842712 0.81 L3MBTL1 (0.34)
SCHEMBL609261 0.76 SMN1; SMN2 (0.42) KMT2ACA12CA1CA9KDM4E
SCHEMBL150342 0.76 SMN1; SMN2 (0.42) KMT2ACA12CA1CA9KDM4E
SCHEMBL11233108 0.73 GLO1 (0.38) KMT2ASIGMAR1
SCHEMBL16599190 0.72 GNAI3 (0.35) KMT2ASIGMAR1OPRD1
SCHEMBL15710894 0.72 OPRD1 (0.35) CA2CA12CA1CA9SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2217646-A1 POROUS POLYMERIC RESINS 3M Innovative Properties Company (US) 2010-08-18 EP disclosed
WO-2009061759-A1 POROUS POLYMERIC RESINS 3M INNOVATIVE PROPERTIES COMPANY (US) 2009-05-14 WO disclosed
EP-1538486-A1 TONER COATED WITH THIN FILM Toppan Forms Co., Ltd. (JP) 2005-06-08 EP disclosed
US-5702860-A ADDING COAGULANT AND SOLVENT TO POLYMER PARTICLE DISPERSION, HEATING TO COAGULATE PARTICLES; TONERS FOR ELECTROGRAPHY KONICA CORPORATION (JP) 1997-12-30 US disclosed