SCHEMBL29034769

SCHEMBL29034769

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

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.55
ALDH1A1 P00352 4/20 0.55
MAPT P10636 4/20 0.55
HSD17B10 Q99714 3/20 0.55
LMNA P02545 2/20 0.55
HTT P42858 2/20 0.55
EGFR P00533 1/20 0.49
ERBB2 P04626 1/20 0.49
GAA P10253 3/20 0.49
PKM P14618 1/20 0.47
MEN1 O00255 2/20 0.47
ALOX15 P16050 2/20 0.46
TSHR P16473 2/20 0.46
TP53 P04637 1/20 0.46
CYP3A4 P08684 1/20 0.46
ALOX12 P18054 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
TGM2 P21980 1/20 0.44
TDP1 Q9NUW8 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.43

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
SCHEMBL15546571 0.84 KMT2A (0.56) KMT2AALDH1A1MAPTHSD17B10LMNA
SCHEMBL8631220 0.83 KMT2A (0.76) KMT2AALDH1A1MAPTHSD17B10LMNA
SCHEMBL11336269 0.83 KMT2A (0.47) KMT2AALDH1A1MAPTHSD17B10LMNA
SCHEMBL15567082 0.83 KMT2A (0.46) KMT2AALDH1A1MAPTHSD17B10LMNA
SCHEMBL29034906 0.83 KMT2A (0.46) KMT2AALDH1A1MAPTHSD17B10LMNA
SCHEMBL114036 0.82 PRSS1 (0.46) KMT2AALDH1A1MAPTHSD17B10LMNA
SCHEMBL29034760 0.82 SMN1; SMN2 (0.47) KMT2AALDH1A1MAPTHSD17B10LMNA
SCHEMBL21994120 0.81 THRB (0.45) KMT2AALDH1A1MAPTHSD17B10LMNA
SCHEMBL10797070 0.81 TUBB4A (0.43) KMT2AALDH1A1MAPTHSD17B10LMNA
SCHEMBL4644295 0.80 KMT2A (0.60) KMT2AALDH1A1MAPTHSD17B10LMNA

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
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