SCHEMBL4845238

SCHEMBL4845238

CC1=CC(=O)N(c2ccc(N3C(=O)C=CC3=O)c3ccccc23)C1=O

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 12/20 0.49
TLR9 Q9NR96 3/20 0.47
FAAH O00519 1/20 0.41
ALDH1A1 P00352 2/20 0.38
PKM P14618 2/20 0.38
MAPT P10636 1/20 0.38
HPGD P15428 1/20 0.38
HSD17B10 Q99714 1/20 0.38
HSP90AA1 P07900 2/20 0.35
CCR6 P51684 1/20 0.35
ATM Q13315 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
G6PD P11413 1/20 0.35
POLB P06746 1/20 0.34
ESR1 P03372 1/20 0.34
ESR2 Q92731 1/20 0.34

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
SCHEMBL4846646 0.93 MGLL (0.49) MGLLTLR9FAAHALDH1A1PKM
SCHEMBL8886696 0.93 ALDH1A1 (0.38) MGLLTLR9ALDH1A1PKMMAPT
SCHEMBL2229804 0.88 TLR9 (0.63) MGLLTLR9FAAHALDH1A1PKM
SCHEMBL8886650 0.86 POLB (0.42) MGLLTLR9ALDH1A1PKMMAPT
SCHEMBL31180023 0.82 TLR9 (0.68) MGLLTLR9FAAHALDH1A1PKM
SCHEMBL5077484 0.82 TLR9 (0.68) MGLLTLR9FAAHALDH1A1PKM
SCHEMBL2230828 0.81 MGLL (0.50) MGLLTLR9FAAHALDH1A1PKM
SCHEMBL29999844 0.80 POLB (0.57) MGLLALDH1A1PKMMAPTHPGD
SCHEMBL9073572 0.80 POLB (0.57) MGLLALDH1A1PKMMAPTHPGD
SCHEMBL7193393 0.80 TLR9 (0.48) MGLLTLR9FAAHPKMMAPT

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
US-7442733-B2 Rubber composition comprising a citraconimidomaleimide MICHELIN RECHERCHE ET TECHNIQUE S.A. (CH) 2008-10-28 US disclosed
US-20060247342-A1 Rubber composition comprising a citraconimidomaleimide MICHELIN RECHERCHE ET TECHNIQUE S.A. 2006-11-02 US disclosed
EP-1664180-A1 RUBBER COMPOSITION COMPRISING A CITRACONIMIDO-MALEIMIDE Société de Technologie Michelin (FR) 2006-06-07 EP disclosed
WO-2005026250-A1 RUBBER COMPOSITION COMPRISING A CITRACONIMIDO-MALEIMIDE SOCIETE DE TECHNOLOGIE MICHELIN (FR) 2005-03-24 WO disclosed