SCHEMBL8145111

SCHEMBL8145111

COCCCC1CCN(CCNC(C)=O)CC1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
HTR4 Q13639 4/20 0.41
POLB P06746 1/20 0.40
CYP3A4 P08684 2/20 0.39
CYP2D6 P10635 2/20 0.38
KCNH2 Q12809 2/20 0.38
CACNA1H O95180 1/20 0.38
HTT P42858 1/20 0.38
CACNA1I Q9P0X4 1/20 0.37
CHRM4 P08173 1/20 0.37
NAAA Q02083 1/20 0.37

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
SCHEMBL8148004 0.82 TDP1 (0.51) TDP1MEN1KMT2APOLB
SCHEMBL8138605 0.80 NPC1 (0.48) MEN1KMT2APOLBCACNA1I
SCHEMBL8145102 0.79 TDP1 (0.46) TDP1MEN1KMT2APOLBHTT
SCHEMBL8159848 0.79 TDP1 (0.54) TDP1MEN1KMT2APOLB
SCHEMBL14586758 0.76 HTR1A (0.46) TDP1MEN1KMT2APOLBHTT
SCHEMBL18850978 0.75 TDP1 (0.50) TDP1MEN1KMT2APOLBCYP2D6
SCHEMBL18850977 0.74 HTR4 (0.41) TDP1MEN1KMT2AHTR4POLB
SCHEMBL29325547 0.74 CARM1 (0.42) TDP1KMT2APOLB
SCHEMBL29325463 0.74 POLB (0.41) MEN1KMT2APOLBCHRM4
SCHEMBL19049361 0.74 KDM4E (0.45) MEN1KMT2A

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-2008119741-A2 3-IMIDAZOLYL-INDOLES FOR THE TREATMENT OF PROLIFERATIVE DISEASES NOVARTIS AG (CH) 2008-10-09 WO disclosed