SCHEMBL8907825

SCHEMBL8907825

Nc1nc(NCCOCCO)nc(N(CCOCCO)CCOCCO)n1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KCNH3 Q9ULD8 3/20 0.43
SLC29A1 Q99808 8/20 0.35
ALDH1A1 P00352 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
HTR7 P34969 2/20 0.30
ADRA1D P25100 1/20 0.30
ADRA1A P35348 1/20 0.30
ADRA1B P35368 1/20 0.30
LATS1 O95835 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
SCHEMBL8040116 0.86 ALDH1A1 (0.32) ALDH1A1HTR7ADRA1DADRA1AADRA1B
SCHEMBL2843832 0.83 KCNH3 (0.56) KCNH3ALDH1A1MEN1KMT2AHTR7
SCHEMBL2370363 0.83 KCNH3 (0.53) KCNH3ALDH1A1MEN1KMT2AHTR7
SCHEMBL7777696 0.82 KCNH3 (0.51) KCNH3ALDH1A1MEN1KMT2AHTR7
SCHEMBL1077004 0.79 SLC29A1 (0.46) SLC29A1ALDH1A1MEN1KMT2AADRA1A
SCHEMBL8467538 0.78 KCNH3 (0.51) KCNH3ALDH1A1MEN1KMT2AHTR7
SCHEMBL1292560 0.75 KCNH3 (0.65) KCNH3ALDH1A1MEN1KMT2ALATS1
SCHEMBL10454781 0.73 CA1 (0.38) SLC29A1ALDH1A1MEN1KMT2AHTR7
SCHEMBL3301414 0.73 SLC29A1 (0.51) SLC29A1MEN1KMT2A
SCHEMBL14715387 0.71 SLC29A1 (0.60) SLC29A1ALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0408947-A2 Melamine resin article with higher elasticity BASF Aktiengesellschaft (DE) 1991-01-23 EP claimed
US-5637704-A Preparation of hydroxyoxaalkylmelamines BASF AKTIENGESELLSCHAFT (DE) 1997-06-10 US disclosed
EP-0520182-B1 Condensates of sulphonated phenols, urea, other organic nitrogen containing bases and formaldehyde and their use as tanning agent or as spray composition for redispersable polymer powders BASF AG (DE) 1996-03-20 EP disclosed
US-5342916-A Condensation polymers of sulfonated phenols, urea, other organic nitrogen-bases, and formaldehyde, and their use as tanning agents and as spraying aids for redispersible polymer powders BASF AKTIENGESELLSCHAFT (DE) 1994-08-30 US disclosed
EP-0520182-A1 Condensates of sulphonated phenols, urea, other organic nitrogen containing bases and formaldehyde and their use as tanning agent or as spray composition for redispersable polymer powders BASF Aktiengesellschaft (DE) 1992-12-30 EP disclosed
EP-0408947-A2 Melamine resin article with higher elasticity BASF Aktiengesellschaft (DE) 1991-01-23 EP disclosed