SCHEMBL11495151

SCHEMBL11495151

CCN1CCN(CCC(C)(O)c2ccccc2-c2ccccc2)CC1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.49
ALDH1A1 P00352 3/20 0.49
KDM4E B2RXH2 2/20 0.49
MEN1 O00255 3/20 0.48
TDP1 Q9NUW8 1/20 0.46
SLC6A4 P31645 2/20 0.44
SLC6A3 Q01959 2/20 0.44
MAPK1 P28482 1/20 0.43
RAB9A P51151 1/20 0.43
PKM P14618 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
NCOA3 Q9Y6Q9 1/20 0.42
HSD11B1 P28845 1/20 0.40
CHRNA7 P36544 1/20 0.40
LMNA P02545 1/20 0.39
HTT P42858 1/20 0.39
CHRM3 P20309 1/20 0.39

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
SCHEMBL11487644 0.90 LMNA (0.49) KMT2AALDH1A1KDM4EMEN1SLC6A4
SCHEMBL11494400 0.90 CHRM4 (0.48) KMT2AALDH1A1KDM4EMEN1SLC6A4
SCHEMBL11489482 0.89 CYP2D6 (0.50) KMT2AALDH1A1KDM4EMEN1TDP1
SCHEMBL11487383 0.88 CYP2D6 (0.52) KMT2AALDH1A1KDM4EMEN1TDP1
SCHEMBL11489627 0.87 CHRM3 (0.46) KMT2AALDH1A1KDM4EMEN1PKM
SCHEMBL11492203 0.86 CHRM2 (0.47) KMT2AALDH1A1KDM4EMEN1TDP1
SCHEMBL11486718 0.85 KDM4E (0.48) KMT2AALDH1A1KDM4EMEN1RAB9A
SCHEMBL11488616 0.84 SLC6A4 (0.40) KMT2AALDH1A1KDM4EMEN1SLC6A4
SCHEMBL11489633 0.84 ALDH1A1 (0.52) KMT2AALDH1A1KDM4EMEN1MAPK1
SCHEMBL11495149 0.81 SLC6A4 (0.55) KMT2AALDH1A1MEN1SLC6A4SLC6A3

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
US-4239759-A Morpholino containing compounds, compositions and use thereof MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1980-12-16 US disclosed
US-4110447-A Anti-inflammatory (halo-4-biphenylyl)-alkanolamines MERCK PATENT GESELLSCHAFT MIT BESCHRAENKTER HAFTUNG (DE) 1978-08-29 US disclosed