SCHEMBL2354681

SCHEMBL2354681

CCCC(O)CCCN(C)C

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 4/20 0.44
ALDH1A1 P00352 1/20 0.39
TSHR P16473 1/20 0.39
HTR2A P28223 1/20 0.38
HRH1 P35367 1/20 0.38
FFAR4 Q5NUL3 1/20 0.36
FFAR1 O14842 1/20 0.36
NFKB1 P19838 1/20 0.35
GPR84 Q9NQS5 5/20 0.34
MAPT P10636 1/20 0.32
FDPS P14324 1/20 0.31
CYP1A2 P05177 1/20 0.30
CYP2D6 P10635 1/20 0.30

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
SCHEMBL17526552 0.91 DNM1 (0.50) DNM1ALDH1A1TSHRHTR2AHRH1
SCHEMBL17526769 0.91 DNM1 (0.50) DNM1ALDH1A1TSHRHTR2AHRH1
SCHEMBL2454527 0.90 ALDH1A1 (0.47) DNM1ALDH1A1TSHRHTR2AHRH1
SCHEMBL9671940 0.87 ALDH1A1 (0.45) DNM1ALDH1A1TSHRHTR2AHRH1
SCHEMBL17526579 0.84 DNM1 (0.61) DNM1ALDH1A1TSHRFFAR4FFAR1
SCHEMBL17526498 0.84 DNM1 (0.61) DNM1ALDH1A1TSHRFFAR4FFAR1
SCHEMBL17526715 0.84 DNM1 (0.54) DNM1ALDH1A1TSHRFFAR4FFAR1
SCHEMBL19577839 0.84 DNM1 (0.54) DNM1ALDH1A1TSHRFFAR4FFAR1
SCHEMBL17526837 0.84 DNM1 (0.54) DNM1ALDH1A1TSHRFFAR4FFAR1
SCHEMBL23394580 0.83 ALDH1A1 (0.41) DNM1ALDH1A1TSHRHTR2AHRH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107820527-B Polyurethane-organopolysiloxanes 鲁道夫有限公司 2021-05-28 CN disclosed
WO-2016185209-A1 CURING COMPOSITIONS AQDOT LIMITED (GB) 2016-11-24 WO disclosed
EP-2350167-A1 ANTIFOAMING COMPOSITIONS Wacker Chemie AG (DE) 2011-08-03 EP disclosed
WO-2010057855-A1 ANTIFOAMING COMPOSITIONS WACKER CHEMIE AG (DE) 2010-05-27 WO disclosed
EP-1885770-A1 DEFOAMER FORMULATIONS Wacker Chemie AG (DE) 2008-02-13 EP disclosed
EP-1753804-A2 METHOD FOR MODIFYING FIBROUS SUBSTRATES WITH SILOXANE COPOLYMERS Wacker Chemie AG (DE) 2007-02-21 EP disclosed
WO-2006128624-A1 DEFOAMER FORMULATIONS WACKER CHEMIE AG (DE) 2006-12-07 WO disclosed
WO-2005121218-A2 METHOD FOR MODIFYING FIBROUS SUBSTRATES WITH SILOXANE COPOLYMERS WACKER CHEMIE AG (DE) 2005-12-22 WO disclosed
EP-1572780-A2 HYDROPHILIC COPOLYSILOXANES AND METHOD FOR THE PRODUCTION THEREOF Wacker-Chemie GmbH (DE) 2005-09-14 EP disclosed
WO-2004056907-A2 HYDROPHILIC COPOLYSILOXANES AND METHOD FOR THE PRODUCTION THEREOF WACKER-CHEMIE GMBH (DE) 2004-07-08 WO disclosed