SCHEMBL27744153

SCHEMBL27744153

CCCC(=O)Oc1ccncc1N

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 2/20 0.46
KDM4E B2RXH2 3/20 0.44
ALDH1A1 P00352 2/20 0.44
GLA P06280 1/20 0.44
GAA P10253 1/20 0.44
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
KDM6B O15054 1/20 0.41
KDM4A O75164 1/20 0.41
MAPT P10636 1/20 0.41
THRB P10828 1/20 0.41
KDM4D Q6B0I6 1/20 0.41
KDM4C Q9H3R0 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
BCL9 O00512 1/20 0.38
CTNNB1 P35222 1/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38

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
SCHEMBL27601691 0.87 KDM4E (0.46) ALOX15KDM4EALDH1A1GLAGAA
SCHEMBL27793490 0.81 ALOX15 (0.46) ALOX15KDM4EALDH1A1GLAGAA
SCHEMBL27672225 0.80 LMNA (0.50) KDM4EALDH1A1KMT2AMEN1KDM6B
SCHEMBL20213796 0.79 ALOX15 (0.47) ALOX15KDM4EALDH1A1KMT2AMEN1
SCHEMBL4634601 0.79 KDM4E (0.56) KDM4EALDH1A1GLAGAAKMT2A
SCHEMBL28816979 0.78 KDM4E (0.50) KDM4EALDH1A1GLAGAAKMT2A
SCHEMBL1162157 0.77 KDM4E (0.51) ALOX15KDM4EALDH1A1KMT2AMEN1
SCHEMBL28776408 0.77 BCL9 (0.50) ALOX15ALDH1A1GAAKMT2AMEN1
SCHEMBL29256723 0.76 KDM4E (0.48) KDM4EALDH1A1GLAGAAKMT2A
SCHEMBL4633528 0.76 ALDH1A1 (0.53) KDM4EALDH1A1GLAGAAKMT2A

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
CN-101312968-A Indazoles, benzothiazoles, benzoisothiazoles, benzisoxazoles, pyrazolopyridines, isothiazolopyridines, and preparation and uses thereof MEMORY PHARM CORP (US) 2008-11-26 CN disclosed