SCHEMBL6694645

SCHEMBL6694645

CCOC(=O)c1ccccc1OC(=O)CI

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.61
ALDH1A1 P00352 5/20 0.53
MAPT P10636 3/20 0.53
HSD17B10 Q99714 3/20 0.53
KDM4E B2RXH2 6/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
RECQL P46063 1/20 0.47
USP2 O75604 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2C9 P11712 1/20 0.46
ALOX15 P16050 1/20 0.46
CYP2C19 P33261 1/20 0.46
MAPK10 P53779 1/20 0.46
PTK2B Q14289 1/20 0.46
NCOA1 Q15788 1/20 0.46
NCOA3 Q9Y6Q9 1/20 0.46
CDC25B P30305 2/20 0.46
TBXAS1 P24557 1/20 0.45

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
SCHEMBL8587612 0.87 TSHR (0.65) TSHRALDH1A1MAPTHSD17B10KDM4E
SCHEMBL8498851 0.87 TSHR (0.65) TSHRALDH1A1MAPTHSD17B10KDM4E
SCHEMBL6696648 0.87 TSHR (0.51) TSHRALDH1A1MAPTHSD17B10KDM4E
SCHEMBL6693915 0.84 TSHR (0.61) TSHRALDH1A1MAPTHSD17B10KDM4E
SCHEMBL6693369 0.84 TSHR (0.61) TSHRALDH1A1MAPTHSD17B10KDM4E
SCHEMBL8499422 0.84 MEN1 (0.61) TSHRALDH1A1MAPTHSD17B10KDM4E
SCHEMBL6699868 0.84 TSHR (0.61) TSHRALDH1A1MAPTHSD17B10KDM4E
SCHEMBL7209562 0.84 MEN1 (0.61) TSHRALDH1A1MAPTHSD17B10KDM4E
SCHEMBL14384075 0.84 TSHR (0.65) TSHRALDH1A1MAPTHSD17B10KDM4E
SCHEMBL1283310 0.83 TSHR (0.69) TSHRALDH1A1MAPTHSD17B10KDM4E

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