SCHEMBL579540

SCHEMBL579540

CN(C)CCCN(CCCN(C)C)CC(O)CN

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.35
TSHR P16473 1/20 0.35
TDP1 Q9NUW8 3/20 0.33
KDM4E B2RXH2 1/20 0.32
MAPK1 P28482 1/20 0.32
HRH4 Q9H3N8 2/20 0.31
CYP1A2 P05177 1/20 0.31
HRH2 P25021 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
HSD17B10 Q99714 1/20 0.31
HTR2A P28223 1/20 0.31
HRH1 P35367 1/20 0.31
DNM1 Q05193 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
SCHEMBL2974977 0.83 ALDH1A1 (0.35) ALDH1A1TSHRTDP1KDM4EHRH4
SCHEMBL20530185 0.82 TDP1 (0.38) ALDH1A1TSHRTDP1CYP2C9CYP2C19
SCHEMBL28289558 0.82 ALDH1A1 (0.34) ALDH1A1TSHRTDP1HRH4CYP1A2
SCHEMBL20530224 0.81 TDP1 (0.37) ALDH1A1TSHRTDP1CYP2C9CYP2C19
SCHEMBL7356304 0.81 KDM4E (0.46) ALDH1A1TDP1KDM4EMAPK1
SCHEMBL2510804 0.81 ALDH1A1 (0.36) ALDH1A1TSHRTDP1KDM4EMAPK1
SCHEMBL21775942 0.78 ALDH1A1 (0.41) ALDH1A1TSHRTDP1HRH4CYP1A2
SCHEMBL16813073 0.78 HTT (0.47) TDP1KDM4EMAPK1DNM1
SCHEMBL14619487 0.77 PLA2G1B (0.35) TSHRTDP1KDM4EMAPK1HTR2A
SCHEMBL24791611 0.76 KDM4E (0.40) ALDH1A1TSHRTDP1KDM4EMAPK1

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1656406-B1 DEVICE FOR PRODUCING POLYETHER ALCOHOLS BASF SE (DE) 2012-02-15 EP claimed
US-20060258832-A1 Device for producing polyether alcohols BASF AKTIENGESELLSCHAFT (DE) 2006-11-16 US claimed
EP-1656406-A1 DEVICE FOR PRODUCING POLYETHER ALCOHOLS BASF AKTIENGESELLSCHAFT (DE) 2006-05-17 EP claimed
WO-2005014685-A1 DEVICE FOR PRODUCING POLYETHER ALCOHOLS BASF AKTIENGESELLSCHAFT (DE) 2005-02-17 WO claimed
US-20190153187-A1 PROCESS FOR PREPARING POLYISOCYANURATE RIGID FOAMS BASF POLYURETHANES GMBH (DE) 2019-05-23 US disclosed
EP-3458491-A1 PROCESS FOR PREPARING POLYISOCYANURATE RIGID FOAMS BASF SE (DE) 2019-03-27 EP disclosed
CN-109153764-A PROCESS FOR PREPARING POLYISOCYANURATE RIGID FOAMS 巴斯夫欧洲公司 2019-01-04 CN disclosed
WO-2017198747-A1 PROCESS FOR PREPARING POLYISOCYANURATE RIGID FOAMS BASF SE (DE) 2017-11-23 WO disclosed
US-20170190080-A1 COMPOSITE MATERIAL COMPOSED OF OUTER LAYER AND POLYURETHANE FOAM LAYER BASF SE (DE) 2017-07-06 US disclosed
EP-3149062-A1 COMPOSITE MATERIAL COMPOSED OF OUTER LAYER AND POLYURETHANE FOAM LAYER BASF SE (DE) 2017-04-05 EP disclosed
WO-2015185448-A1 COMPOSITE MATERIAL COMPOSED OF OUTER LAYER AND POLYURETHANE FOAM LAYER BASF SE (DE) 2015-12-10 WO disclosed
EP-2438101-A1 COMPOSITE PARTS CONTAINING PLASTICALLY DEFORMABLE RIGID POLYURETHANE FOAM, ADHESIVE, AND COVERING MATERIAL BASF SE (DE) 2012-04-11 EP disclosed
EP-1924356-B1 METHOD FOR THE PRODUCTION OF POLYISOCYANURATE RIGID FOAM BASF SE (DE) 2010-01-20 EP disclosed
EP-1841578-B1 METHOD AND DEVICE FOR PRODUCTION OF MOULDED FOAM PIECES MADE FROM POLYURETHANE FRIMO GROUP GMBH (DE) 2009-07-22 EP disclosed
US-20080234402-A1 catalyst system, in particular for rigid polyisocyanurate foams blown by means of formic acid BASF SE (DE) 2008-09-25 US disclosed
EP-1924356-A1 POLYISOCYANURATE RIGID FOAM AND METHOD FOR THE PRODUCTION THEREOF BASF SE (DE) 2008-05-28 EP disclosed
WO-2007025888-A1 POLYISOCYANURATE RIGID FOAM AND METHOD FOR THE PRODUCTION THEREOF BASF SE (DE) 2007-03-08 WO disclosed
US-20060258832-A1 Device for producing polyether alcohols BASF AKTIENGESELLSCHAFT (DE) 2006-11-16 US disclosed
EP-1656406-A1 DEVICE FOR PRODUCING POLYETHER ALCOHOLS BASF AKTIENGESELLSCHAFT (DE) 2006-05-17 EP disclosed
WO-2005014685-A1 DEVICE FOR PRODUCING POLYETHER ALCOHOLS BASF AKTIENGESELLSCHAFT (DE) 2005-02-17 WO disclosed