SCHEMBL8962232

SCHEMBL8962232

C=CC(=O)NCNc1nc(N)nc(N)n1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.50
ALDH1A1 P00352 1/20 0.50
TSHR P16473 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
CYP1A2 P05177 1/20 0.36
CA1 P00915 2/20 0.34
CA2 P00918 2/20 0.34
CA9 Q16790 2/20 0.34
TGM2 P21980 1/20 0.33
ZDHHC20 Q5W0Z9 1/20 0.33
ZDHHC2 Q9UIJ5 1/20 0.33
MAP3K14 Q99558 1/20 0.32
NPC1 O15118 1/20 0.30
TP53 P04637 1/20 0.30
GLA P06280 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL93702 0.76 TGM2 (0.39) MAPK1ALDH1A1TSHRTDP1CYP1A2
Acrylic Acid SCHEMBL9005484 0.74 ALOX15 (0.37) MAPK1CYP1A2CA1CA2CA9
SCHEMBL9420180 0.73 XPO1 (0.38) MAPK1ALDH1A1TSHRTDP1CYP1A2
SCHEMBL5906873 0.72 CA1 (0.42) CYP1A2CA1CA2CA9NPC1
SCHEMBL22356329 0.72 TGM2 (0.39) MAPK1ALDH1A1TSHRTDP1TGM2
SCHEMBL20000 0.70 TSHR (1.00) MAPK1ALDH1A1TSHRTDP1TGM2
SCHEMBL11053017 0.70 TSHR (1.00) MAPK1ALDH1A1TSHRTDP1TGM2
SCHEMBL10552719 0.70 TSHR (1.00) MAPK1ALDH1A1TSHRTDP1TGM2
SCHEMBL9063318 0.69 ALDH1A1 (0.31) ALDH1A1
SCHEMBL9639821 0.69 CYP1A2 (0.33) MAPK1CYP1A2CA1CA2CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0519151-B1 Crosslinkable resin composition comprising a thermoplastic resin MONSANTO EUROPE SA (BE) 1996-02-07 EP claimed
US-5281674-A Thermoplastic resin blends MONSANTO COMPANY (US) 1994-01-25 US claimed
EP-0519151-A1 Crosslinkable resin composition comprising a thermoplastic resin MONSANTO EUROPE S.A./N.V. (BE) 1992-12-23 EP claimed
EP-0366884-A2 Novel vinyl-terminated carbamylmethylated melamines, vinyl-terminated polyurethane/polyamide polymers and coating/adhesive compositions containing same CYTEC TECHNOLOGY CORP. (US) 1990-05-09 EP claimed
EP-0519151-B1 Crosslinkable resin composition comprising a thermoplastic resin MONSANTO EUROPE SA (BE) 1996-02-07 EP disclosed
US-5288523-A Containing a (meth)acryoyl or (meth)allyloxy compound MONSANTO COMPANY (US) 1994-02-22 US disclosed
US-5281674-A Thermoplastic resin blends MONSANTO COMPANY (US) 1994-01-25 US disclosed
EP-0519151-A1 Crosslinkable resin composition comprising a thermoplastic resin MONSANTO EUROPE S.A./N.V. (BE) 1992-12-23 EP disclosed
US-5093462-A Solvent resistant coatings MONSANTO COMPANY (US) 1992-03-03 US disclosed
US-4931537-A CURABLE EPOXY SYSTEMS; HYDROXY-FUNCTIONAL GLYCIDAMIDES FROM AMINO RESINS; SOLVENT, WEATHER RESISTANT MONSANTO COMPANY (US) 1990-06-05 US disclosed
US-4931536-A PRECURSORS FOR EPOXIDIZED ANINO RESINS; METHYLOLATING CYCLIC UREA OR MELAMINE COMPONENTS, ETHERIFICATION, ACRYLAMIDATION, TRANSETHERIFICATION, EPOXIDATION MONSANTO COMPANY (US) 1990-06-05 US disclosed
EP-0366884-A2 Novel vinyl-terminated carbamylmethylated melamines, vinyl-terminated polyurethane/polyamide polymers and coating/adhesive compositions containing same CYTEC TECHNOLOGY CORP. (US) 1990-05-09 EP disclosed
EP-0345240-A2 Hydroxy functional acrylamidomethyl amino resins and hydroxy functional glycidamidomethyl amino resins MONSANTO COMPANY (US) 1989-12-06 EP disclosed
EP-0344144-A2 Polyglycidamide coating compositions MONSANTO COMPANY (US) 1989-11-29 EP disclosed