SCHEMBL6693604

SCHEMBL6693604

O=C(CI)Oc1ccccc1OC(=O)CI

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.42
MAPT P10636 4/20 0.42
L3MBTL1 Q9Y468 2/20 0.41
KDM4E B2RXH2 4/20 0.41
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
RECQL P46063 1/20 0.41
ACHE P22303 1/20 0.40
SERPINE1 P05121 1/20 0.39
TDP1 Q9NUW8 2/20 0.39
ATM Q13315 1/20 0.39
HSD17B10 Q99714 3/20 0.38
HPGD P15428 2/20 0.38
ALOX15 P16050 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
PTGDR2 Q9Y5Y4 1/20 0.37
TP53 P04637 1/20 0.37
PTGS2 P35354 2/20 0.37
MAPK1 P28482 1/20 0.37
ESR1 P03372 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
SCHEMBL6690405 0.84 KDM4E (0.61) ALDH1A1MAPTKDM4EKMT2AMEN1
SCHEMBL10297495 0.81 TSHR (0.45) ALDH1A1MAPTL3MBTL1KDM4EKMT2A
SCHEMBL27897124 0.81 TDP1 (0.54) ALDH1A1MAPTKDM4EKMT2AMEN1
SCHEMBL1654541 0.80 RAB9A (0.54) ALDH1A1MAPTL3MBTL1KDM4EKMT2A
SCHEMBL1762271 0.79 CYP19A1 (0.52) ALDH1A1MAPTL3MBTL1KDM4EKMT2A
SCHEMBL18076011 0.78 POLB (0.51) ALDH1A1MAPTL3MBTL1KMT2AMEN1
SCHEMBL27809607 0.77 CYP19A1 (0.50) ALDH1A1MAPTL3MBTL1KDM4EKMT2A
SCHEMBL6694645 0.77 TSHR (0.61) ALDH1A1MAPTL3MBTL1KDM4EKMT2A
SCHEMBL8435546 0.76 ALOX15 (0.55) ALDH1A1MAPTL3MBTL1KDM4EKMT2A
SCHEMBL6691255 0.76 TOP2A (0.45) ALDH1A1MAPTL3MBTL1KDM4EKMT2A

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
EP-0950669-B1 Method of catalytic crosslinking of polymers and two-pack composition used therein ROHM & HAAS (US) 2004-09-08 EP disclosed
US-6306991-B1 TWO PART COATING COMPOSITION WITH TWO CONTAINERS, OXIDATIVE POLYMERS WITH CROSSLINKABLE FUNCTIONAL GROUPS ROHM AND HAAS COMPANY 2001-10-23 US disclosed
US-6149977-A CONTACTING THE OXIDATIVE POLYMER WITH A CATALYTIC AMOUNT OF AN OXIDIZING ENZYME, SUCH AS HORSERADISH PEROXIDASE. ROHM AND HAAS COMPANY (US) 2000-11-21 US disclosed
EP-0950669-A2 Method of catalytic crosslinking of polymers and two-pack composition used therein ROHM AND HAAS COMPANY (US) 1999-10-20 EP disclosed