SCHEMBL27367109

SCHEMBL27367109

C=CCCC(=O)Oc1ccc(C)cc1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.54
LMNA P02545 3/20 0.50
ALDH1A1 P00352 3/20 0.50
HTT P42858 2/20 0.50
MAPT P10636 1/20 0.50
HSD17B10 Q99714 1/20 0.50
GAA P10253 2/20 0.49
MEN1 O00255 1/20 0.47
HPGD P15428 1/20 0.46
L3MBTL1 Q9Y468 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
NPC1 O15118 1/20 0.43
BCL9 O00512 1/20 0.41
CTNNB1 P35222 1/20 0.41
MAPK1 P28482 1/20 0.40

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
SCHEMBL28158388 0.87 LMNA (0.54) KMT2ALMNAALDH1A1HTTMAPT
SCHEMBL29034769 0.86 KMT2A (0.55) KMT2ALMNAALDH1A1HTTMAPT
SCHEMBL645265 0.83 KMT2A (0.69) KMT2ALMNAALDH1A1HTTMAPT
SCHEMBL11336269 0.83 KMT2A (0.47) KMT2ALMNAALDH1A1HTTMAPT
SCHEMBL29034906 0.83 KMT2A (0.46) KMT2ALMNAALDH1A1HTTMAPT
SCHEMBL15567082 0.83 KMT2A (0.46) KMT2ALMNAALDH1A1HTTMAPT
SCHEMBL114036 0.82 PRSS1 (0.46) KMT2ALMNAALDH1A1HTTMAPT
SCHEMBL28115800 0.82 LMNA (0.52) KMT2ALMNAALDH1A1HTTMAPT
SCHEMBL11793851 0.82 LMNA (0.56) KMT2ALMNAALDH1A1MAPTGAA
SCHEMBL29034760 0.82 SMN1; SMN2 (0.47) KMT2ALMNAALDH1A1HTTMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116396185-B Preparation method of N-allyl aryl hydrazine compound 江西师范大学 2023-08-18 CN disclosed
CN-116396185-A Preparation method of N-allyl aryl hydrazine compound 江西师范大学 2023-07-07 CN disclosed
CN-1054586-A New substituted amine compound and preparation method thereof FUJISAWA PHARMACEUTICAL CO (JP) 1991-09-18 CN disclosed