SCHEMBL11285229

SCHEMBL11285229

Cc1c(CN(C)C)ccc(O)c1CN(C)C

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.54
ALDH1A1 P00352 5/20 0.54
GAA P10253 4/20 0.54
MEN1 O00255 3/20 0.54
KMT2A Q03164 3/20 0.54
MAPT P10636 2/20 0.54
TDP1 Q9NUW8 2/20 0.54
POLB P06746 1/20 0.54
THRB P10828 1/20 0.54
G6PD P11413 1/20 0.54
PABPC1 P11940 1/20 0.54
HKDC1 Q2TB90 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
ADRB2 P07550 1/20 0.46
HSD17B10 Q99714 3/20 0.44
GLA P06280 3/20 0.44
HPGD P15428 3/20 0.44
CASP1 P29466 2/20 0.44
CASP7 P55210 2/20 0.44
PKM P14618 1/20 0.42

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
SCHEMBL20439356 0.89 ALDH1A1 (0.52) KDM4EALDH1A1GAAMEN1KMT2A
SCHEMBL28111035 0.83 KDM4E (0.58) KDM4EALDH1A1GAAMEN1KMT2A
SCHEMBL27799002 0.83 ALDH1A1 (0.58) KDM4EALDH1A1GAAMEN1KMT2A
SCHEMBL29349627 0.83 ALDH1A1 (0.58) KDM4EALDH1A1GAAMEN1KMT2A
SCHEMBL33427 0.83 ALDH1A1 (0.58) KDM4EALDH1A1GAAMEN1KMT2A
SCHEMBL30517750 0.82 KDM4E (0.50) KDM4EALDH1A1GAAMEN1KMT2A
Ammonia Solution, Strong SCHEMBL27570173 0.82 ALDH1A1 (0.56) KDM4EALDH1A1GAAMEN1KMT2A
SCHEMBL11408846 0.78 ALDH1A1 (0.56) KDM4EALDH1A1GAAMEN1KMT2A
SCHEMBL11352201 0.75 TYR (0.53) KDM4EALDH1A1GAAMEN1KMT2A
Piperazine SCHEMBL10545727 0.74 ALDH1A1 (0.47) KDM4EALDH1A1GAAMEN1KMT2A

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
US-4322304-A ANTIOXIDANTS PHILLIPS PETROLEUM COMPANY (US) 1982-03-30 US disclosed