SCHEMBL9160069

SCHEMBL9160069

ClCC(CCl)OCC1CO1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.42
TDP1 Q9NUW8 3/20 0.42
TSHR P16473 3/20 0.39
MAPK1 P28482 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.34
TP53 P04637 2/20 0.32
CYP3A4 P08684 2/20 0.32
HIF1A Q16665 1/20 0.32
GLA P06280 1/20 0.31

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
SCHEMBL11263631 0.87 ALDH1A1 (0.36) ALDH1A1TDP1TSHRMAPK1SMN1; SMN2
SCHEMBL11263628 0.87 ALDH1A1 (0.36) ALDH1A1TDP1TSHRMAPK1SMN1; SMN2
SCHEMBL11428334 0.86 ALDH1A1 (0.45) ALDH1A1TDP1TSHRMAPK1SMN1; SMN2
SCHEMBL16078925 0.82 ALDH1A1 (0.34) ALDH1A1TDP1TSHRMAPK1SMN1; SMN2
SCHEMBL14453509 0.81 SMN1; SMN2 (0.42) ALDH1A1TDP1TSHRMAPK1SMN1; SMN2
SCHEMBL15827401 0.80 ALDH1A1 (0.32) ALDH1A1TDP1TSHRMAPK1SMN1; SMN2
SCHEMBL15000603 0.78 ALDH1A1 (0.40) ALDH1A1TDP1TSHRMAPK1SMN1; SMN2
SCHEMBL11671065 0.77
SCHEMBL20851115 0.77 ALDH1A1 (0.39) ALDH1A1TDP1TSHRMAPK1SMN1; SMN2
SCHEMBL15831675 0.77 TSHR (0.39) ALDH1A1TDP1TSHRMAPK1SMN1; SMN2

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-0421379-B1 Preparation of monoepoxides DOW CHEMICAL CO (US) 1995-03-15 EP disclosed
EP-0421379-A1 Preparation of monoepoxides THE DOW CHEMICAL COMPANY (US) 1991-04-10 EP disclosed
US-4341658-A CATIONIC, AND ANIONIC POLYMER CATALYSTS THE DOW CHEMICAL CO. (US) 1982-07-27 US disclosed
US-4276406-A COMPRISING A SUBSTRATE WITH ION EXCHANGEABLE CATIONS REACTED WITH A CATIONIC POLYMER THE DOW CHEMICAL COMPANY (US) 1981-06-30 US disclosed