SCHEMBL9327201

SCHEMBL9327201

N#CCCCCN(OCc1ccccc1)C(=O)CCCCCCCBr

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.42
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
TSHR P16473 1/20 0.38
CYP2C19 P33261 1/20 0.38
BCHE P06276 1/20 0.38
ACHE P22303 1/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
GUSB P08236 2/20 0.36
KDM4A O75164 2/20 0.36
KDM4C Q9H3R0 2/20 0.36
HDAC3 O15379 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC2 Q92769 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
NCOR2 Q9Y618 1/20 0.36
KDM5A P29375 1/20 0.36
PHF8 Q9UPP1 1/20 0.36
KDM2A Q9Y2K7 1/20 0.36

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
SCHEMBL9326206 1.00 L3MBTL1 (0.42) L3MBTL1CYP3A4CYP2C9TSHRCYP2C19
SCHEMBL9326166 0.89 L3MBTL1 (0.44) L3MBTL1MEN1KMT2A
SCHEMBL9326236 0.89 L3MBTL1 (0.44) L3MBTL1CYP3A4CYP2C9TSHRCYP2C19
SCHEMBL9326820 0.88 L3MBTL1 (0.41) L3MBTL1CYP3A4CYP2C9TSHRCYP2C19
SCHEMBL9326758 0.88 L3MBTL1 (0.41) L3MBTL1CYP3A4CYP2C9TSHRCYP2C19
SCHEMBL9325011 0.87 L3MBTL1 (0.42) L3MBTL1CYP3A4CYP2C9TSHRCYP2C19
SCHEMBL9543318 0.86 L3MBTL1 (0.42) L3MBTL1CYP3A4CYP2C9TSHRCYP2C19
SCHEMBL9325048 0.85 L3MBTL1 (0.39) L3MBTL1CYP3A4CYP2C9TSHRCYP2C19
SCHEMBL9327986 0.85 L3MBTL1 (0.39) L3MBTL1CYP3A4CYP2C9TSHRCYP2C19
SCHEMBL9326780 0.84 L3MBTL1 (0.64) L3MBTL1

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-5364965-A Analogs of desferrioxamine B and method for synthesis thereof UNIVERSITY OF FLORIDA (US) 1994-11-15 US disclosed
US-5322961-A Analogs of desferrioxamine B and method for synthesis thereof UNIVERSITY OF FLORIDA (US) 1994-06-21 US disclosed