SCHEMBL829949

SCHEMBL829949

C=C(C)C(=O)OCCCC.C=C(CC)C(=O)OC(=O)C(=CC=Cc1ccccc1)CCCO

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.48
TDP1 Q9NUW8 3/20 0.44
POLB P06746 2/20 0.40
ALDH1A1 P00352 5/20 0.40
HPGD P15428 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
TSHR P16473 3/20 0.38
LMNA P02545 4/20 0.37
GAA P10253 1/20 0.37
MAPT P10636 1/20 0.37
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
APEX1 P27695 1/20 0.36
HTT P42858 1/20 0.36
L3MBTL1 Q9Y468 2/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33

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
SCHEMBL829552 0.89 LMNA (0.40) KDM4ETDP1POLBALDH1A1HPGD
SCHEMBL7584448 0.81 KDM4E (0.45) KDM4ETDP1POLBALDH1A1HPGD
SCHEMBL1160270 0.79 TSHR (0.52) KDM4ETDP1POLBALDH1A1MEN1
SCHEMBL4243868 0.78 KDM4E (0.60) KDM4ETDP1POLBALDH1A1HPGD
SCHEMBL9513128 0.78 POLB (0.46) KDM4ETDP1POLBALDH1A1HPGD
SCHEMBL35852 0.76 KDM4E (0.49) KDM4ETDP1POLBALDH1A1HPGD
SCHEMBL11525853 0.76 KDM4E (0.54) KDM4ETDP1POLBALDH1A1HPGD
SCHEMBL1857611 0.75 TDP1 (0.54) KDM4ETDP1POLBALDH1A1MEN1
SCHEMBL8407555 0.74 POLB (0.46) KDM4ETDP1POLBALDH1A1HPGD
Styrene SCHEMBL11856902 0.74 TSHR (0.42) KDM4ETDP1POLBALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1705519-B1 Method of treating a microelectronic substrate ROHM & HAAS ELECT MAT (US) 2016-07-06 EP disclosed
US-8142988-B2 Coating compositions for use with an overcoated photoresist ROHM AND HAAS ELECTRONIC MATERIALS LLC (US) 2012-03-27 US disclosed
US-20060275696-A1 Coating compositions for use with an overcoated photoresist ROHM AND HAAS ELECTRONIC MATERIALS LLC (US) 2006-12-07 US disclosed
US-20060228646-A1 Coating compositions for use with an overcoated photoresist ROHM AND HAAS ELECTRONIC MATERIALS LLC (US) 2006-10-12 US disclosed
EP-1705519-A2 Coating compositions for use with an overcoated photoresist Rohm and Haas Electronic Materials, L.L.C. (US) 2006-09-27 EP disclosed