SCHEMBL7992064

SCHEMBL7992064

CCOC(=O)C(=NO)C(=O)c1ccc(OC(C)C)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.47
NPSR1 Q6W5P4 2/20 0.46
PPARG P37231 1/20 0.46
NCOA2 Q15596 1/20 0.46
NCOA1 Q15788 1/20 0.46
NCOA3 Q9Y6Q9 1/20 0.46
PARP10 Q53GL7 1/20 0.46
MAPT P10636 7/20 0.45
SCN5A Q14524 1/20 0.41
SCN2A Q99250 1/20 0.41
POLB P06746 2/20 0.41
TP53 P04637 2/20 0.40
NPY1R P25929 1/20 0.40
NPY2R P49146 1/20 0.40
ALDH1A1 P00352 3/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
THRB P10828 1/20 0.39
HTT P42858 1/20 0.39
HDAC3 O15379 1/20 0.38
HDAC1 Q13547 1/20 0.38

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
SCHEMBL7992061 1.00 KMT2A (0.47) KMT2ANPSR1PPARGNCOA2NCOA1
SCHEMBL17420757 0.85 KMT2A (0.56) KMT2ANPSR1PPARGNCOA2NCOA1
SCHEMBL7988181 0.84 CES2 (0.53) MAPTALDH1A1HTTHDAC3HDAC1
SCHEMBL7991618 0.84 PARP10 (0.50) KMT2ANPSR1PARP10MAPTSCN2A
SCHEMBL7991620 0.84 PARP10 (0.50) KMT2ANPSR1PARP10MAPTSCN2A
SCHEMBL7988180 0.84 CES2 (0.53) MAPTALDH1A1HTTHDAC3HDAC1
SCHEMBL18017521 0.82 CES2 (0.48) KMT2ANPSR1MAPTPOLBALDH1A1
SCHEMBL7991679 0.82 CES2 (0.48) KMT2ANPSR1MAPTPOLBALDH1A1
SCHEMBL7991675 0.82 CES2 (0.48) KMT2ANPSR1MAPTPOLBALDH1A1
SCHEMBL16613214 0.81 NPC1 (0.49) PPARGPARP10MAPTALDH1A1THRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6288061-B1 INTERLEUKIN INHIBITORS; ASTHMA, BRONCHODILATOR AGENTS, ANTIALLERGENS WELFIDE CORPORATION (JP) 2001-09-11 US disclosed