SCHEMBL20824903

SCHEMBL20824903

CCCC/N=C/c1ccc(/C=N/CCC)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.68
KMT2A Q03164 4/20 0.68
MAPT P10636 4/20 0.39
KDM4E B2RXH2 3/20 0.39
GAA P10253 1/20 0.39
TAAR1 Q96RJ0 1/20 0.38
CA2 P00918 7/20 0.38
GRIN2D O15399 1/20 0.38
GRIN3B O60391 1/20 0.38
GRIN1 Q05586 1/20 0.38
GRIN2A Q12879 1/20 0.38
GRIN2B Q13224 1/20 0.38
GRIN2C Q14957 1/20 0.38
GRIN3A Q8TCU5 1/20 0.38
MIF P14174 1/20 0.37
CA9 Q16790 4/20 0.36
MEN1 O00255 3/20 0.36
CA1 P00915 2/20 0.36
MAPK1 P28482 2/20 0.36
CA7 P43166 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
SCHEMBL5680683 0.96 ALDH1A1 (0.61) ALDH1A1KMT2AMAPTKDM4EGAA
SCHEMBL5680680 0.96 ALDH1A1 (0.61) ALDH1A1KMT2AMAPTKDM4EGAA
SCHEMBL20417359 0.91 ALDH1A1 (0.57) ALDH1A1KMT2AMAPTKDM4EGAA
SCHEMBL5687703 0.91 ALDH1A1 (0.79) ALDH1A1KMT2AKDM4EGAATAAR1
SCHEMBL5687699 0.91 ALDH1A1 (0.79) ALDH1A1KMT2AKDM4EGAATAAR1
SCHEMBL21975288 0.88 ALDH1A1 (0.53) ALDH1A1KMT2AMAPTKDM4EGAA
SCHEMBL14196484 0.88 KMT2A (0.53) ALDH1A1KMT2AMAPTKDM4EGAA
SCHEMBL9810590 0.87 ALDH1A1 (0.57) ALDH1A1KMT2AMAPTKDM4ETAAR1
SCHEMBL9810599 0.87 ALDH1A1 (0.57) ALDH1A1KMT2AMAPTKDM4ETAAR1
SCHEMBL5728586 0.86 KMT2A (0.52) ALDH1A1KMT2AHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2019053269-A1 INJECTABLE HYBRID ALGINATE HYDROGELS AND USES THEREOF UNIVERSITÉ DE STRASBOURG (FR) 2019-03-21 WO disclosed