SCHEMBL8969144

SCHEMBL8969144

Cc1cc(Br)cc(C)c1OC(C)Oc1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.36
PKM P14618 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
NQO2 P16083 1/20 0.34
PPARA Q07869 3/20 0.33
PPARG P37231 1/20 0.33
MAPT P10636 2/20 0.32
TP53 P04637 1/20 0.32
MAPK1 P28482 1/20 0.32
SLC6A4 P31645 1/20 0.32
MTNR1A P48039 1/20 0.32
MTNR1B P49286 1/20 0.32
ALDH1A1 P00352 3/20 0.32
CYP1A2 P05177 2/20 0.31
CYP2D6 P10635 1/20 0.31
CHRNB4 P30926 2/20 0.31
CHRNA3 P32297 2/20 0.31
MAOB P27338 2/20 0.31

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
SCHEMBL8968876 0.78 MEN1 (0.37) KDM4EPKMSMN1; SMN2MEN1KMT2A
SCHEMBL8968707 0.77 KDM4E (0.33) KDM4EPKMMEN1KMT2ANQO2
SCHEMBL8968465 0.77 LDHA (0.48) KDM4EPKMSMN1; SMN2MEN1KMT2A
SCHEMBL542873 0.77 KDM4E (0.50) KDM4EPKMMEN1KMT2ATP53
Dimethylamine SCHEMBL9504815 0.75 KDM4E (0.46) KDM4EPKMMEN1KMT2ATP53
SCHEMBL9770385 0.75 KDM4E (0.46) KDM4EPKMMEN1KMT2ATP53
SCHEMBL8419889 0.73 LMNA (0.47) KDM4ESMN1; SMN2MEN1KMT2AMAPT
SCHEMBL2544650 0.73 LMNA (0.36) KDM4EPKMMEN1KMT2ANQO2
SCHEMBL5283963 0.73 TDP1 (0.58) KDM4EPKMSMN1; SMN2MEN1KMT2A
Methylamine SCHEMBL10763289 0.72 KDM4E (0.47) KDM4EPKMMEN1KMT2ATP53

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-0696284-A1 HETEROCYCLIC DERIVATIVES ZENECA LIMITED (GB) 1996-02-14 EP disclosed