SCHEMBL8146602

SCHEMBL8146602

Cc1nc(NCCOCCO)nc(NCCOCCO)n1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH3 Q9ULD8 4/20 0.56
KMT2A Q03164 4/20 0.42
MEN1 O00255 3/20 0.42
GAA P10253 2/20 0.42
MAPK1 P28482 2/20 0.42
HTR7 P34969 1/20 0.40
ALDH1A1 P00352 3/20 0.39
KDM4E B2RXH2 2/20 0.39
HPGD P15428 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
HSD17B10 Q99714 2/20 0.39
GLA P06280 1/20 0.39
CASP1 P29466 1/20 0.39
HTT P42858 1/20 0.39
CASP7 P55210 1/20 0.39
TSHR P16473 2/20 0.37
NPC1 O15118 1/20 0.36
TP53 P04637 1/20 0.36
MAPT P10636 1/20 0.36
CTNNB1 P35222 1/20 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
SCHEMBL1292560 0.90 KCNH3 (0.65) KCNH3KMT2AMEN1GAAMAPK1
SCHEMBL8676105 0.82 KCNH3 (0.47) KCNH3KMT2AMEN1GAAMAPK1
SCHEMBL2843832 0.81 KCNH3 (0.56) KCNH3KMT2AMEN1GAAMAPK1
SCHEMBL6639253 0.81 KCNH3 (0.56) KCNH3KMT2AALDH1A1MAPT
SCHEMBL8039569 0.80 KMT2A (0.61) KCNH3KMT2AMEN1GAAMAPK1
SCHEMBL5470953 0.78 KCNH3 (0.56) KCNH3KMT2AMEN1GAAMAPK1
SCHEMBL8468622 0.78 KCNH3 (0.53) KCNH3KMT2AMEN1GAAMAPK1
SCHEMBL2370363 0.78 KCNH3 (0.53) KCNH3KMT2AMEN1GAAMAPK1
SCHEMBL7777696 0.76 KCNH3 (0.51) KCNH3KMT2AMEN1GAAMAPK1
SCHEMBL18210952 0.76 KCNH3 (0.51) KCNH3KMT2AMEN1ALDH1A1

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
US-6031064-A Condensation products based on triazines and formaldehyde BASF AKTIENGESELLSCHAFT (DE) 2000-02-29 US disclosed
EP-0883635-B1 CONDENSATION PRODUCTS BASED ON TRIAZINES AND FORMALDEHYDE BASF AG (DE) 1999-12-15 EP disclosed
EP-0845010-B1 MODIFIED MELAMINE FORMALDEHYDE RESINS BASF AG (DE) 1999-12-15 EP disclosed
US-5939515-A Modified melamine-formaldehyde resins BASF AKTIENGESELLSCHAFT (DE) 1999-08-17 US disclosed
EP-0883635-A1 CONDENSATION PRODUCTS BASED ON TRIAZINES AND FORMALDEHYDE BASF AKTIENGESELLSCHAFT (DE) 1998-12-16 EP disclosed
WO-1997031958-A1 CONDENSATION PRODUCTS BASED ON TRIAZINES AND FORMALDEHYDE BASF AKTIENGESELLSCHAFT (DE) 1997-09-04 WO disclosed