SCHEMBL10967299

SCHEMBL10967299

CCOCC(Cl)OCc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.43
CA1 P00915 4/20 0.39
CA2 P00918 2/20 0.39
CA7 P43166 2/20 0.39
CA9 Q16790 2/20 0.39
ALDH1A1 P00352 3/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
TACR1 P25103 2/20 0.38
MAPT P10636 1/20 0.37
SLC1A3 P43003 2/20 0.37
SLC1A2 P43004 2/20 0.37
SLC1A1 P43005 2/20 0.37
MEN1 O00255 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
KMT2A Q03164 1/20 0.37
IDO1 P14902 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
SCHEMBL1456871 0.81 TSHR (0.44) TSHRALDH1A1MAPTSLC1A3SLC1A2
SCHEMBL6005452 0.79 TSHR (0.49) TSHRCA1CA2CA7CA9
SCHEMBL29191646 0.79 TSHR (0.43) TSHRCA1CA2CA7CA9
SCHEMBL8114209 0.78 PPARG (0.42) TSHRALDH1A1MAPTSLC1A3SLC1A2
SCHEMBL7568648 0.76 TSHR (0.40) TSHRCA1CA2CA7CA9
SCHEMBL28132299 0.76 TSHR (0.43) TSHRCA1CA2CA7CA9
SCHEMBL3292550 0.76 TSHR (0.43) TSHRALDH1A1MAPTSLC1A3SLC1A2
SCHEMBL8114978 0.75 CETP (0.41) TSHRALDH1A1SLC1A3SLC1A2SLC1A1
SCHEMBL14667806 0.75 TSHR (0.46) TSHRALDH1A1SLC1A3SLC1A2SLC1A1
SCHEMBL22268846 0.75 TSHR (0.39) TSHRCA1CA2CA7CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4511394-A Substituted benzyloxy chloroethoxy ethane herbicide antidotes STAUFFER CHEMICAL CO. (US) 1985-04-16 US disclosed
US-4511394-A Substituted benzyloxy chloroethoxy ethane herbicide antidotes STAUFFER CHEMICAL CO. (US) 1985-04-16 US disclosed
US-4489007-A Substituted benzyloxy chloroethoxy ethane herbicide antidotes STAUFFER CHEMICAL COMPANY (US) 1984-12-18 US disclosed
US-4489007-A Substituted benzyloxy chloroethoxy ethane herbicide antidotes STAUFFER CHEMICAL COMPANY (US) 1984-12-18 US disclosed
US-4400204-A PLANT SAFENING AGENTS FOR USE WITH ALKYL THIOCARBAMATES STAUFFER CHEMICAL COMPANY (US) 1983-08-23 US disclosed
US-4400204-A PLANT SAFENING AGENTS FOR USE WITH ALKYL THIOCARBAMATES STAUFFER CHEMICAL COMPANY (US) 1983-08-23 US disclosed