SCHEMBL10299484

SCHEMBL10299484

CCc1cc(OC(C)=O)ccc1N(C)C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.44
KDM4E B2RXH2 4/20 0.44
CYP3A4 P08684 2/20 0.43
HTR1D P28221 1/20 0.43
ACHE P22303 2/20 0.42
MAPT P10636 3/20 0.41
POLB P06746 2/20 0.41
CA12 O43570 2/20 0.41
CA9 Q16790 2/20 0.41
PKM P14618 1/20 0.41
GLA P06280 1/20 0.41
GAA P10253 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
MEN1 O00255 1/20 0.40
TTR P02766 1/20 0.40
TP53 P04637 1/20 0.40
KMT2A Q03164 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
FLT3 P36888 1/20 0.40
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
Hydrochloric Acid SCHEMBL29353358 0.85 RAB9A (0.55) LMNAACHEPKMGAAMEN1
SCHEMBL11773130 0.81 ACHE (0.51) LMNAKDM4ECYP3A4HTR1DACHE
SCHEMBL10175247 0.80 AOC3 (0.44)
SCHEMBL13233739 0.77 KDM4E (0.46) KDM4ECYP3A4CA12CA9GAA
SCHEMBL10480044 0.74 KDM4E (0.67) LMNAKDM4ECYP3A4ACHEMAPT
SCHEMBL5861768 0.74 LMNA (0.49) LMNAKDM4ECYP3A4ACHEMAPT
SCHEMBL12861332 0.73 HSD17B10 (0.47) LMNAKDM4ECYP3A4MAPTTP53
SCHEMBL3049927 0.73 LMNA (0.48) LMNAKDM4ECYP3A4ACHEMAPT
SCHEMBL10591054 0.73 CYP3A4 (0.56) LMNAKDM4ECYP3A4ACHEMAPT
SCHEMBL792335 0.72 FSCN1 (0.41) LMNAMAPTPOLBGAASMN1; SMN2

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-1550662-B1 ADENINE COMPOUND AND USE THEREOF DAINIPPON SUMITOMO PHARMA CO (JP) 2012-07-04 EP disclosed