SCHEMBL14213344

SCHEMBL14213344

CCCCCCCCCC(CCCCC)N(C)C=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADH1C P00326 3/20 0.44
ADH1A P07327 3/20 0.44
ADH4 P08319 3/20 0.44
ADH1B P00325 2/20 0.44
ADH7 P40394 2/20 0.44
TSHR P16473 1/20 0.39
MAPT P10636 2/20 0.38
TRPA1 O75762 1/20 0.38
DDAH1 O94760 1/20 0.38
GAPDH P04406 1/20 0.38
GPR84 Q9NQS5 3/20 0.38
FDPS P14324 3/20 0.38
FFAR1 O14842 1/20 0.38
EPHX1 P07099 1/20 0.37
LMNA P02545 1/20 0.37
LCK P06239 1/20 0.36
PPARD Q03181 1/20 0.36
ZDHHC20 Q5W0Z9 1/20 0.36
ZDHHC2 Q9UIJ5 1/20 0.36
DNM1 Q05193 2/20 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
SCHEMBL20835176 0.84 FAAH (0.48) TSHRMAPTLMNAPPARD
SCHEMBL18998303 0.81 ADH1B (0.47) ADH1CADH1AADH4ADH1BADH7
SCHEMBL4912735 0.79 MAPT (0.44) ADH1CADH1AADH4ADH1BADH7
SCHEMBL728057 0.78 ADH1B (0.44) ADH1CADH1AADH4ADH1BADH7
SCHEMBL20835187 0.78 TSHR (0.39) ADH1CADH1AADH4ADH1BADH7
SCHEMBL276179 0.77 ADH1C (0.42) ADH1CADH1AADH4ADH1BADH7
SCHEMBL27428739 0.75 ADH1C (0.43) ADH1CADH1AADH4ADH1BADH7
SCHEMBL23437461 0.74 TSHR (0.44) TSHRGPR84FDPSLMNADNM1
SCHEMBL22401186 0.74 TSHR (0.44) TSHRGPR84FDPSLMNADNM1
SCHEMBL22096531 0.74 TSHR (0.44) TSHRGPR84FDPSLMNADNM1

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
US-7378485-B2 Peptide nucleic acids with polyamide-containing backbones BUCHARDT OLE 2008-05-27 US disclosed