SCHEMBL6648331

SCHEMBL6648331

CCCCCCCCCCCCCCCC(=O)N1CCCCCC1.CCCCCCCCCCCCCCCCCC(=O)N1CCCCCC1

nearest known ligand 0.96

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.96
MEN1 O00255 2/20 0.96
KMT2A Q03164 2/20 0.96
TDP1 Q9NUW8 1/20 0.96
GNAI3 P08754 8/20 0.66
GNAI1 P63096 8/20 0.66
ATM Q13315 1/20 0.65
GNAO1 P09471 7/20 0.62
POLB P06746 1/20 0.53
MAPT P10636 1/20 0.53

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
SCHEMBL5435751 1.00 L3MBTL1 (0.96) L3MBTL1MEN1KMT2ATDP1GNAI3
SCHEMBL5598310 1.00 L3MBTL1 (0.96) L3MBTL1MEN1KMT2ATDP1GNAI3
SCHEMBL5429914 1.00 L3MBTL1 (0.96) L3MBTL1MEN1KMT2ATDP1GNAI3
SCHEMBL3073495 1.00 L3MBTL1 (0.96) L3MBTL1MEN1KMT2ATDP1GNAI3
SCHEMBL10535915 1.00 L3MBTL1 (0.96) L3MBTL1MEN1KMT2ATDP1GNAI3
SCHEMBL24073266 1.00 L3MBTL1 (0.96) L3MBTL1MEN1KMT2ATDP1GNAI3
N-(Decanoyl)Hexamethyleneimine SCHEMBL6012122 1.00 L3MBTL1 (0.96) L3MBTL1MEN1KMT2ATDP1GNAI3
SCHEMBL10481691 1.00 L3MBTL1 (0.96) L3MBTL1MEN1KMT2ATDP1GNAI3
SCHEMBL5433045 1.00 L3MBTL1 (0.96) L3MBTL1MEN1KMT2ATDP1GNAI3
SCHEMBL3840069 1.00 L3MBTL1 (0.96) L3MBTL1MEN1KMT2ATDP1GNAI3

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
EP-1432405-A1 IBUPROFEN SALT EMULSIFIERS AND CREAM FORMULATIONS CONTAINING SAME MacroChem Corporation (US) 2004-06-30 EP disclosed
WO-2003028702-A1 IBUPROFEN SALT EMULSIFIERS AND CREAM FORMULATIONS CONTAINING SAME MACROCHEM CORPORATION (US) 2003-04-10 WO disclosed