SCHEMBL4844501

SCHEMBL4844501

CC1=CC(=O)N(c2cc(N3C(=O)C=CC3=O)cc3ccccc23)C1=O

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 4/20 0.45
CCR6 P51684 2/20 0.39
MGLL Q99685 11/20 0.39
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
FAAH O00519 3/20 0.37
TLR9 Q9NR96 1/20 0.35
HTT P42858 1/20 0.35
ATM Q13315 1/20 0.35
POLB P06746 1/20 0.35

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
SCHEMBL8884598 0.93 ALDH1A1 (0.38) HSP90AA1ALDH1A1PKMMAPTHPGD
SCHEMBL2919445 0.84 HSP90AA1 (0.58) HSP90AA1CCR6MGLLALDH1A1PKM
SCHEMBL4845238 0.78 MGLL (0.49) HSP90AA1CCR6MGLLALDH1A1PKM
SCHEMBL9073572 0.78 POLB (0.57) MGLLALDH1A1PKMMAPTHPGD
SCHEMBL29999844 0.78 POLB (0.57) MGLLALDH1A1PKMMAPTHPGD
SCHEMBL2229804 0.76 TLR9 (0.63) HSP90AA1CCR6MGLLALDH1A1PKM
SCHEMBL20385941 0.76 CCR6 (0.55) HSP90AA1CCR6MGLLFAAH
SCHEMBL2230092 0.76 MGLL (0.44) HSP90AA1CCR6MGLLALDH1A1PKM
SCHEMBL4846646 0.75 MGLL (0.49) HSP90AA1CCR6MGLLALDH1A1PKM
SCHEMBL8886696 0.74 ALDH1A1 (0.38) MGLLALDH1A1PKMMAPTHPGD

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