SCHEMBL7743766

SCHEMBL7743766

CCCCC(N=C=O)(N=C=O)C(=O)OC

nearest known ligand 0.33

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.33
MEN1 O00255 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
MAPT P10636 1/20 0.33
ATM Q13315 1/20 0.33
EPHX1 P07099 1/20 0.32
USP2 O75604 1/20 0.32
LMNA P02545 1/20 0.32
ALDH1A1 P00352 1/20 0.32
FAAH O00519 1/20 0.32
MAPK1 P28482 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
HSP90AA1 P07900 1/20 0.31
TDP1 Q9NUW8 1/20 0.30
ZDHHC7 Q9NXF8 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
SCHEMBL10629445 0.86 MEN1 (0.41) KMT2AMEN1L3MBTL1MAPTATM
SCHEMBL4468948 0.81 KMT2A (0.32) KMT2AMEN1MAPTALDH1A1TDP1
SCHEMBL23496636 0.79 HPGD (0.30) ALDH1A1
SCHEMBL10978133 0.74 CES2 (0.39) KMT2AMEN1MAPTALDH1A1TDP1
SCHEMBL11476098 0.74 KMT2A (0.43) KMT2AMEN1L3MBTL1MAPTATM
SCHEMBL16222689 0.74
SCHEMBL16222534 0.74
SCHEMBL15204282 0.72
SCHEMBL15233853 0.71 EPHX1 (0.39) KMT2AMEN1L3MBTL1MAPTATM
SCHEMBL28730000 0.71 EPHX1 (0.43) KMT2AMEN1L3MBTL1MAPTATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4169955-A GRAFT POLYMER INTERMEDIATES E. I. DU PONT DE NEMOURS AND COMPANY (US) 1979-10-02 US claimed
CN-110885577-A Active energy ray-curable resin composition, cured product, and laminate 荒川化学工业株式会社 2020-03-17 CN disclosed
EP-1109847-A1 LOW-EMISSION, POLYURETHANE FOAMS WHICH ARE STABLE DURING HYDROLYSIS Performance Chemicals Handels GmbH (DE) 2001-06-27 EP disclosed
WO-2001002459-A1 LOW-EMISSION, POLYURETHANE FOAMS WHICH ARE STABLE DURING HYDROLYSIS PERFORMANCE CHEMICALS HANDELS GMBH (DE) 2001-01-11 WO disclosed