SCHEMBL5200684

SCHEMBL5200684

CCCCCCCCCCC(C)N(CCCC)C(=O)CCC(=O)NCCCC

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 2/20 0.48
CASP2 P42575 1/20 0.47
NAAA Q02083 1/20 0.45
FAAH O00519 7/20 0.43
NOD1 Q9Y239 1/20 0.40
CNR1 P21554 2/20 0.40
MEN1 O00255 1/20 0.40
MAPK1 P28482 1/20 0.40
KMT2A Q03164 1/20 0.40
EPHX1 P07099 3/20 0.39
EPHX2 P34913 2/20 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
SCHEMBL19196491 0.85 DNM1 (0.42) DNM1CASP2NAAAFAAHNOD1
SCHEMBL14229927 0.81 EPHX2 (0.42) EPHX2
SCHEMBL3370091 0.79 EPHX2 (0.51) EPHX2
SCHEMBL14229463 0.79 EPHX2 (0.48) EPHX2
SCHEMBL585370 0.77 CASP2 (0.56) DNM1CASP2NAAAFAAHCNR1
SCHEMBL24415729 0.75 CASP2 (0.62) DNM1CASP2NAAAFAAHEPHX1
SCHEMBL7897141 0.75 CASP2 (0.62) DNM1CASP2NAAAFAAHEPHX1
SCHEMBL26037662 0.75 CASP2 (0.58) DNM1CASP2NAAAFAAHCNR1
SCHEMBL18313754 0.75 CASP2 (0.67) DNM1CASP2NAAAFAAHCNR1
SCHEMBL24415182 0.75 CASP2 (0.67) DNM1CASP2NAAAFAAHEPHX1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20010046479-A1 Anti-microbial antiperspirant products UNILEVER, HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2001-11-29 US claimed
EP-1259215-B1 ANTI-MICROBIAL ANTIPERSPIRANT PRODUCTS UNILEVER PLC (GB) 2007-03-21 EP disclosed
US-20050191255-A1 Anti-microbial antiperspirant products UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2005-09-01 US disclosed
US-6893630-B2 Anti-microbial antiperspirant products UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. (US) 2005-05-17 US disclosed
US-20010046479-A1 Anti-microbial antiperspirant products UNILEVER, HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2001-11-29 US disclosed