SCHEMBL6696648

SCHEMBL6696648

CCOC(=O)c1cccc(OC(=O)CI)c1OC(=O)CI

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.51
ALDH1A1 P00352 2/20 0.45
HSD17B10 Q99714 1/20 0.45
CLEC4M Q9H2X3 1/20 0.43
CDC25B P30305 3/20 0.43
MAPT P10636 4/20 0.42
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
CA14 Q9ULX7 1/20 0.41
MAPK1 P28482 1/20 0.41
CYP1A2 P05177 2/20 0.41
KMT2A Q03164 2/20 0.40
CDC25A P30304 1/20 0.40
CDC25C P30307 1/20 0.40
MEN1 O00255 1/20 0.40
USP2 O75604 1/20 0.40
CYP3A4 P08684 1/20 0.40

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
SCHEMBL6694645 0.87 TSHR (0.61) TSHRALDH1A1HSD17B10CDC25BMAPT
SCHEMBL6692087 0.86 TSHR (0.51) TSHRALDH1A1HSD17B10CLEC4MCDC25B
SCHEMBL6696656 0.86 TSHR (0.51) TSHRALDH1A1HSD17B10CLEC4MCDC25B
SCHEMBL6689490 0.86 TSHR (0.51) TSHRALDH1A1HSD17B10CLEC4MCDC25B
SCHEMBL6691368 0.80 MAPK1 (0.58) TSHRALDH1A1HSD17B10MAPTMAPK1
SCHEMBL28026633 0.75 TSHR (0.56) TSHRALDH1A1HSD17B10CLEC4MCDC25B
SCHEMBL8587612 0.74 TSHR (0.65) TSHRALDH1A1HSD17B10CDC25BMAPT
SCHEMBL7688461 0.74 KMT2A (0.65) TSHRALDH1A1HSD17B10CDC25BMAPT
SCHEMBL8498851 0.74 TSHR (0.65) TSHRALDH1A1HSD17B10CDC25BMAPT
SCHEMBL23773427 0.73 TSHR (0.68) TSHRALDH1A1HSD17B10CLEC4MCDC25B

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