SCHEMBL11067706

SCHEMBL11067706

C=C(COc1ccc(C)cc1)C(N)=O

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
WDR5 P61964 1/20 0.58
HPGD P15428 3/20 0.51
MAPT P10636 3/20 0.51
LMNA P02545 1/20 0.50
GAA P10253 1/20 0.50
NPC1 O15118 3/20 0.49
RAB9A P51151 2/20 0.49
PARP10 Q53GL7 1/20 0.49
L3MBTL1 Q9Y468 4/20 0.47
TDP1 Q9NUW8 2/20 0.47
ALDH1A1 P00352 2/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
HDAC1 Q13547 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
NPSR1 Q6W5P4 1/20 0.45
KDM4E B2RXH2 1/20 0.45

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
SCHEMBL11072974 0.84 L3MBTL1 (0.53) WDR5HPGDMAPTLMNAGAA
Hydrochloric Acid SCHEMBL11071528 0.82 L3MBTL1 (0.51) WDR5HPGDMAPTLMNAGAA
SCHEMBL11071525 0.82 MAPT (0.51) WDR5HPGDMAPTLMNAGAA
SCHEMBL11114121 0.81 ALOX15 (0.59) HPGDMAPTGAANPC1RAB9A
SCHEMBL171832 0.81 WDR5 (0.66) WDR5HPGDMAPTLMNAGAA
SCHEMBL11425674 0.77 MAPT (0.61) WDR5HPGDMAPTLMNAGAA
Formaldehyde SCHEMBL28606314 0.76 L3MBTL1 (0.61) WDR5HPGDMAPTLMNAGAA
SCHEMBL8161826 0.75 WDR5 (0.57) WDR5HPGDMAPTLMNAGAA
SCHEMBL503652 0.75 L3MBTL1 (0.66) WDR5HPGDMAPTLMNAGAA
SCHEMBL11126183 0.75 MAPT (0.59) WDR5HPGDMAPTLMNAGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0118685-A1 Propene derivatives and their use as plant growth inhibitors DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1984-09-19 EP disclosed
EP-0117412-A1 Propene derivatives and their use as plant growth inhibitors DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1984-09-05 EP disclosed