SCHEMBL10884151

SCHEMBL10884151

C=C(C)c1ccc(N2C(=O)C=CC2=O)cc1C#N

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.43
PTGS2 P35354 1/20 0.43
MGLL Q99685 11/20 0.41
FAAH O00519 2/20 0.41
NPSR1 Q6W5P4 2/20 0.40
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.40
HPGD P15428 1/20 0.40
HTT P42858 1/20 0.40
HSP90AA1 P07900 5/20 0.40
PKM P14618 1/20 0.40
MAPK1 P28482 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
TLR9 Q9NR96 2/20 0.39
G6PD P11413 1/20 0.39
AR P10275 1/20 0.38
DDAH1 O94760 1/20 0.37
CCR6 P51684 1/20 0.36

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
SCHEMBL10882330 0.80 G6PD (0.49) PTGS1PTGS2MGLLFAAHNPSR1
SCHEMBL11011698 0.80 MGLL (0.47) PTGS1PTGS2MGLLFAAHNPSR1
SCHEMBL11012518 0.78 NPSR1 (0.53) PTGS1PTGS2MGLLFAAHNPSR1
SCHEMBL10886249 0.77 PTGS1 (0.61) PTGS1PTGS2MGLLFAAHNPSR1
SCHEMBL10584544 0.74 TLR9 (0.53) MGLLFAAHNPSR1ALDH1A1HTT
SCHEMBL10883630 0.74 HSP90AA1 (0.49) PTGS1PTGS2MGLLFAAHNPSR1
SCHEMBL10884938 0.73 G6PD (0.56) PTGS1PTGS2MGLLFAAHNPSR1
SCHEMBL10289771 0.70 KDM4E (0.49) ALDH1A1LMNAMAPTHPGDMAPK1
SCHEMBL15716045 0.70 ALDH1A1 (0.37) PTGS2ALDH1A1HPGDTDP1
SCHEMBL10883694 0.70 TLR9 (0.36) MGLLFAAHNPSR1ALDH1A1LMNA

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-0077840-B1 CURABLE RESIN COMPOSITION MITSUI TOATSU CHEMICALS, Inc. (JP) 1986-07-02 EP disclosed
US-4506042-A MOLDING, LAMINATION, VARISH MITSUI TOATSU CHEMICALS, INC. (JP) 1985-03-19 US disclosed
US-4401777-A Curable resin composition comprising N-(alkenylphenyl)maleimide and epoxy composition MITSUI TOATSU CHEMICALS, INC. (JP) 1983-08-30 US disclosed
EP-0077840-A1 Curable resin composition MITSUI TOATSU CHEMICALS, Inc. (JP) 1983-05-04 EP disclosed