SCHEMBL8950934

SCHEMBL8950934

ClC(OCC1CO1)C1CO1

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.38
ALDH1A1 P00352 7/20 0.37
TDP1 Q9NUW8 3/20 0.35
MAPK1 P28482 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
TP53 P04637 2/20 0.31
CYP3A4 P08684 2/20 0.31
HIF1A Q16665 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
SCHEMBL31425200 0.74
SCHEMBL11418992 0.74 TSHR (0.39) TSHRALDH1A1TDP1MAPK1SMN1; SMN2
SCHEMBL7193893 0.74
SCHEMBL30179645 0.73 TSHR (0.39) TSHRALDH1A1TDP1MAPK1SMN1; SMN2
SCHEMBL4744554 0.73 TSHR (0.38) TSHRALDH1A1TDP1MAPK1SMN1; SMN2
SCHEMBL3645580 0.73 TSHR (0.38) TSHRALDH1A1TDP1MAPK1SMN1; SMN2
SCHEMBL6051764 0.73 ALDH1A1 (0.41) TSHRALDH1A1TDP1MAPK1SMN1; SMN2
SCHEMBL5400750 0.73 TSHR (0.38) TSHRALDH1A1TDP1MAPK1SMN1; SMN2
SCHEMBL9515799 0.73 TSHR (0.38) TSHRALDH1A1TDP1MAPK1SMN1; SMN2
SCHEMBL2390211 0.73 TSHR (0.38) TSHRALDH1A1TDP1MAPK1SMN1; 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
US-5567748-A A REACTION PRODUCT OF HYDROPHILIC POLYOXYALKYLENE AMINES AND DIGLYCIDYL ETHERS OF A POLYALKYLENE GLYCOL; CURING AGENTS, EMULSIFIERS, DISPERSANTS; WATERBASE PAINTS THE DOW CHEMICAL COMPANY (US) 1996-10-22 US disclosed
EP-0617726-B1 WATER COMPATIBLE AMINE TERMINATED RESIN USEFUL FOR CURING EPOXY RESINS DOW CHEMICAL CO (US) 1996-01-31 EP disclosed
EP-0617726-A1 WATER COMPATIBLE AMINE TERMINATED RESIN USEFUL FOR CURING EPOXY RESINS. DOW CHEMICAL CO (US) 1994-10-05 EP disclosed
WO-1993012187-A1 WATER COMPATIBLE AMINE TERMINATED RESIN USEFUL FOR CURING EPOXY RESINS THE DOW CHEMICAL COMPANY (US) 1993-06-24 WO disclosed