SCHEMBL13755987

SCHEMBL13755987

CCCCCCCCCCCCC(C)NC(=O)CCN(CCO)CCN(CCC(=O)NC(C)CCCCCCCCCCCC)CCC(=O)NC(C)CCCCCCCCCCCC

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ FAAH O00519 2/20 0.45
▸ MAPK1 P28482 1/20 0.45
▸ ICMT O60725 1/20 0.41
▸ ALB P02768 1/20 0.41
▸ KCNK3 O14649 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ THRB P10828 1/20 0.41
▸ CNR2 P34972 1/20 0.41
▸ BLM P54132 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ ASAH1 Q13510 1/20 0.40
▸ PLA2G10 O15496 2/20 0.39
▸ NOD1 Q9Y239 1/20 0.38
▸ PLA2G2C Q5R387 1/20 0.38
▸ ADH1B P00325 1/20 0.38
▸ ADH1C P00326 1/20 0.38
▸ ADH1A P07327 1/20 0.38
▸ ADH4 P08319 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
SCHEMBL13755990 1.00 MEN1 (0.45) MEN1KMT2AFAAHMAPK1ICMT
SCHEMBL13755983 0.94 FAAH (0.50) MEN1KMT2AFAAHMAPK1ICMT
SCHEMBL13756158 0.94 MEN1 (0.40) MEN1KMT2AFAAHMAPK1ICMT
SCHEMBL13756042 0.92 MEN1 (0.41) MEN1KMT2AFAAHMAPK1ICMT
SCHEMBL10820662 0.91 MEN1 (0.45) MEN1KMT2AFAAHMAPK1ICMT
SCHEMBL13756159 0.91 MEN1 (0.40) MEN1KMT2AFAAHMAPK1ICMT
SCHEMBL10820593 0.90 ICMT (0.46) MEN1KMT2AFAAHMAPK1ICMT
SCHEMBL10820656 0.90 FAAH (0.39) MEN1KMT2AFAAHMAPK1ICMT
SCHEMBL10820731 0.90 FAAH (0.39) MEN1KMT2AFAAHMAPK1ICMT
SCHEMBL10820730 0.89 PRSS1 (0.40) MEN1KMT2AFAAHMAPK1ICMT

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
WO-2009097332-A2 THERAPEUTIC COMPOSITIONS SHIRE HUMAN GENETIC THERAPIES, INC. (US) 2009-08-06 — — WO disclosed
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