SCHEMBL8087449

SCHEMBL8087449

C=CN(CCCCCC)C(=O)CC

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ZDHHC20 Q5W0Z9 2/20 0.42
ZDHHC2 Q9UIJ5 2/20 0.42
FAAH O00519 1/20 0.41
EPHX2 P34913 3/20 0.38
S1PR2 O95136 1/20 0.38
S1PR1 P21453 1/20 0.38
S1PR3 Q99500 1/20 0.38
S1PR5 Q9H228 1/20 0.38
TSHR P16473 1/20 0.37
DNM1 Q05193 2/20 0.37
EPHX1 P07099 2/20 0.36
GGPS1 O95749 3/20 0.36
KDM5A P29375 3/20 0.36
PHF8 Q9UPP1 3/20 0.36
KDM4C Q9H3R0 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
SCHEMBL2950233 0.92 CA12 (0.38) ZDHHC20ZDHHC2FAAHTSHRKDM5A
SCHEMBL28060856 0.87 FAAH (0.47) FAAHEPHX2TSHRKDM5APHF8
SCHEMBL11325370 0.87 FAAH (0.47) FAAHEPHX2TSHRKDM5APHF8
SCHEMBL8079065 0.87 FAAH (0.47) FAAHEPHX2TSHRKDM5APHF8
SCHEMBL26486703 0.85 FAAH (0.41) ZDHHC20ZDHHC2FAAHEPHX2TSHR
SCHEMBL1358419 0.84 ALDH1A1 (0.37) TSHR
SCHEMBL2946449 0.83 FAAH (0.47) FAAHEPHX2TSHRKDM5APHF8
SCHEMBL2941041 0.83 FAAH (0.47) FAAHEPHX2TSHRKDM5APHF8
SCHEMBL2947298 0.83 FAAH (0.47) FAAHEPHX2TSHRKDM5APHF8
SCHEMBL8092281 0.82 ZDHHC20 (0.44) ZDHHC20ZDHHC2FAAHEPHX2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1286924-C Radiation curable composition comprising alkoxylated alphatic reactive diluents DSM NV (NL) 2006-11-29 CN disclosed
CN-1529739-A Radiation curable composition comprising alkoxylated alphatic reactive diluents DSM IP �Ʋ����޹�˾ 2004-09-15 CN disclosed
CN-1412234-A Photosensitive resin composite for gap body of liquid crystal display QIMEI IND CO LTD (CN) 2003-04-23 CN disclosed
EP-1050565-A2 Method of hydrophobisation and preparations for carrying out said method BASF AKTIENGESELLSCHAFT (DE) 2000-11-08 EP disclosed