SCHEMBL2141243

SCHEMBL2141243

CCOC(=O)/C(C#N)=C/c1ccc(-c2ccc(Cl)cc2)o1

nearest known ligand 0.83

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.83
TP53 P04637 7/20 0.83
THRB P10828 2/20 0.83
LMNA P02545 3/20 0.66
NPC1 O15118 2/20 0.66
RAB9A P51151 2/20 0.66
POLB P06746 2/20 0.66
SMN1; SMN2 Q16637 2/20 0.66
ALDH1A1 P00352 3/20 0.58
MEN1 O00255 2/20 0.58
KMT2A Q03164 2/20 0.58
KDM4E B2RXH2 3/20 0.55
RECQL P46063 1/20 0.55
TDP1 Q9NUW8 1/20 0.55
HPGD P15428 1/20 0.52

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
SCHEMBL2141246 1.00 MAPT (0.83) MAPTTP53THRBLMNANPC1
SCHEMBL14472291 0.87 TP53 (0.76) MAPTTP53THRBLMNANPC1
SCHEMBL2138863 0.87 TP53 (0.76) MAPTTP53THRBLMNANPC1
SCHEMBL17465996 0.83 MAPT (0.66) MAPTTP53THRBLMNANPC1
SCHEMBL14472235 0.82 MAPT (0.79) MAPTTP53THRBLMNANPC1
SCHEMBL2137995 0.82 MAPT (0.79) MAPTTP53THRBLMNANPC1
SCHEMBL2825398 0.81 MAPT (0.73) MAPTTP53THRBLMNANPC1
SCHEMBL2825397 0.81 MAPT (0.73) MAPTTP53THRBLMNANPC1
SCHEMBL2576359 0.79 ALDH1A1 (0.71) MAPTLMNANPC1RAB9APOLB
SCHEMBL988798 0.79 ALDH1A1 (0.71) MAPTLMNANPC1RAB9APOLB

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-2242774-B2 SELF-REPAIRING COMPOSITION, SELF-REPAIRING MATERIALS, SELF-REPAIRING METHODS AND APPLICATIONS CATALYSE (FR) 2018-09-26 EP claimed
EP-2242774-B1 SELF-REPAIRING COMPOSITION, SELF-REPAIRING MATERIALS, SELF-REPAIRING METHODS AND APPLICATIONS CATALYSE (FR) 2013-01-09 EP claimed
US-9249237-B2 Self-repairing composition, self-repairing materials, self-repairing methods and applications CATALYSE (FR) 2016-02-02 US disclosed
US-20110057340-A1 SELF-REPAIRING COMPOSITION, SELF-REPAIRING MATERIALS, SELF-REPAIRING METHODS AND APPLICATIONS CATALYSE (FR) 2011-03-10 US disclosed