SCHEMBL9719461

SCHEMBL9719461

CC(N)C(N)(c1ccccc1Oc1ccccc1)c1ccccc1Oc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 1/20 0.41
HRH1 P35367 1/20 0.39
CTNNB1 P35222 1/20 0.39
SLC6A2 P23975 1/20 0.38
SLC6A4 P31645 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.37
ALDH1A1 P00352 1/20 0.37
MAPK1 P28482 1/20 0.37
HTT P42858 1/20 0.37
LMNA P02545 2/20 0.37
POLB P06746 1/20 0.37
GAA P10253 1/20 0.37
KMT2A Q03164 1/20 0.37
LTA4H P09960 2/20 0.37
TSHR P16473 1/20 0.37
KDM1A O60341 2/20 0.37
DPP4 P27487 1/20 0.37
ATM Q13315 1/20 0.36
TSPO P30536 1/20 0.35
ACACB O00763 1/20 0.35

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
SCHEMBL8320818 0.78 RIPK1 (0.50) RIPK1HRH1CTNNB1SLC6A2SLC6A4
SCHEMBL9719460 0.77 SLC6A4 (0.42) RIPK1HRH1CTNNB1SLC6A2SLC6A4
SCHEMBL9722972 0.75 LTA4H (0.45) ALDH1A1MAPK1HTTLTA4HTSHR
SCHEMBL278540 0.74 RIPK1 (0.53) RIPK1HRH1CTNNB1SLC6A2SLC6A4
SCHEMBL8776759 0.74 RIPK1 (0.53) RIPK1HRH1CTNNB1SLC6A2SLC6A4
Ammonia Solution, Strong SCHEMBL9248440 0.72 RIPK1 (0.52) RIPK1HRH1CTNNB1SLC6A2SLC6A4
SCHEMBL3034914 0.71 SLC6A4 (0.49) RIPK1HRH1CTNNB1SLC6A2SLC6A4
SCHEMBL4350378 0.71 ALDH1A1 (0.47) RIPK1HRH1CTNNB1SLC6A2SLC6A4
SCHEMBL548378 0.71 RIPK1 (0.50) RIPK1HRH1CTNNB1SLC6A2SLC6A4
SCHEMBL11176072 0.70 DPP4 (0.47) RIPK1HRH1CTNNB1SLC6A2SLC6A4

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-5081196-A Containing an acetylenically unsaturated monoamine compound UBE INDUSTRIES, LTD. (JP) 1992-01-14 US claimed
EP-0357367-A2 Terminal-modified aromatic imide oligomer composition UBE INDUSTRIES, LTD. (JP) 1990-03-07 EP claimed
US-5147943-A Thermosetting resin; polyimide containing a modifying monoamine alcohol UBE INDUSTRIES, LTD. (JP) 1992-09-15 US disclosed
US-5081196-A Containing an acetylenically unsaturated monoamine compound UBE INDUSTRIES, LTD. (JP) 1992-01-14 US disclosed
EP-0379131-A2 Thermosetting resin composition UBE INDUSTRIES, LTD. (JP) 1990-07-25 EP disclosed
EP-0357367-A2 Terminal-modified aromatic imide oligomer composition UBE INDUSTRIES, LTD. (JP) 1990-03-07 EP disclosed