SCHEMBL9562066

SCHEMBL9562066

CCCCOC(N)=O.CCCCOC(N)=O.[Zn]

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.58
ATM Q13315 1/20 0.54
ALOX15 P16050 1/20 0.52
TSHR P16473 6/20 0.50
HPGD P15428 1/20 0.50
RAB9A P51151 2/20 0.48
MAPT P10636 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
LMNA P02545 5/20 0.48
CYP2C19 P33261 3/20 0.48
CHRM2 P08172 2/20 0.48
CHRM4 P08173 2/20 0.48
CHRM5 P08912 2/20 0.48
CHRM1 P11229 2/20 0.48
CHRM3 P20309 2/20 0.48
HTR1A P08908 1/20 0.48
CHRNB2 P17787 1/20 0.48
CHRNA7 P36544 1/20 0.48
CHRNA4 P43681 1/20 0.48
HCAR2 Q8TDS4 1/20 0.47

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
SCHEMBL42522 0.97
Urea SCHEMBL27867524 0.95 ALDH1A1 (0.58) ALDH1A1ATMALOX15TSHRHPGD
Phosphine SCHEMBL28287744 0.95
Ethane SCHEMBL28008042 0.95 ALDH1A1 (0.58) ALDH1A1ATMALOX15TSHRHPGD
Ammonia Solution, Strong SCHEMBL27843243 0.95
Hydrochloric Acid SCHEMBL10429397 0.95
Bicarbonate SCHEMBL7632521 0.93 ALDH1A1 (0.56) ALDH1A1ATMALOX15TSHRHPGD
Formaldehyde SCHEMBL27582133 0.93 ALDH1A1 (0.56) ALDH1A1ATMALOX15TSHRHPGD
Ethyne SCHEMBL8587147 0.93 ALDH1A1 (0.56) ALDH1A1ATMALOX15TSHRHPGD
Benzene SCHEMBL27766013 0.91 LMNA (0.55) ALDH1A1ATMALOX15TSHRHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0542268-A1 Latex rubber product and method for manufacturing the same SUMITOMO RUBBER INDUSTRIES LIMITED (JP) 1993-05-19 EP disclosed