SCHEMBL9358558

SCHEMBL9358558

C=CCN(CC=C)c1ccccc1/N=C/c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.41
KDM4E B2RXH2 4/20 0.41
LMNA P02545 3/20 0.41
MAPT P10636 3/20 0.41
HPGD P15428 3/20 0.41
L3MBTL1 Q9Y468 2/20 0.35
G6PC1 P35575 1/20 0.34
SMN1; SMN2 Q16637 3/20 0.34
RAB9A P51151 2/20 0.34
MEN1 O00255 1/20 0.34
POLB P06746 1/20 0.34
HTT P42858 1/20 0.34
BLM P54132 1/20 0.34
KMT2A Q03164 1/20 0.34
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
DHODH Q02127 1/20 0.33
CA12 O43570 1/20 0.33
CA9 Q16790 1/20 0.33
PTPN1 P18031 1/20 0.33

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
SCHEMBL8672113 1.00 ALDH1A1 (0.41) ALDH1A1KDM4ELMNAMAPTHPGD
SCHEMBL6567757 0.80 C5AR1 (0.37) ALDH1A1KDM4ELMNAHPGDSMN1; SMN2
SCHEMBL8066324 0.75 ALDH1A1 (0.40) ALDH1A1KDM4ELMNAMAPTHPGD
SCHEMBL9362615 0.74 KDM4E (0.49) ALDH1A1KDM4ELMNAMAPTHPGD
SCHEMBL8773372 0.74 KDM4E (0.49) ALDH1A1KDM4ELMNAMAPTHPGD
SCHEMBL1710167 0.72 LMNA (0.59) ALDH1A1KDM4ELMNAMAPTHPGD
SCHEMBL1870853 0.72 LMNA (0.59) ALDH1A1KDM4ELMNAMAPTHPGD
SCHEMBL12633216 0.72 LMNA (0.59) ALDH1A1KDM4ELMNAMAPTHPGD
SCHEMBL11371193 0.71 LMNA (0.44) ALDH1A1KDM4ELMNAMAPTHPGD
SCHEMBL8672110 0.71 ALDH1A1 (0.40) ALDH1A1KDM4ELMNAMAPTL3MBTL1

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
EP-0451604-B1 Diene polymers and copolymers terminated by reaction with n-alkyl and n-aryl imines BRIDGESTONE FIRESTONE INC (US) 1994-12-21 EP claimed