SCHEMBL8997997

SCHEMBL8997997

CCCC(CCO)CCCCO

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
ALDH1A1 P00352 4/20 0.43
TSHR P16473 4/20 0.43
HSD17B10 Q99714 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
CA2 P00918 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
OPRM1 P35372 1/20 0.33
CHRM1 P11229 1/20 0.33
AKR1A1 P14550 1/20 0.33
CHRM3 P20309 1/20 0.33
HTR2A P28223 1/20 0.33
HTR2C P28335 1/20 0.33
ADRA1A P35348 1/20 0.33
HRH1 P35367 1/20 0.33
DRD3 P35462 1/20 0.33
SLC6A3 Q01959 1/20 0.33
HDAC1 Q13547 1/20 0.33

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
SCHEMBL6440890 0.95 LMNA (0.50) LMNASMN1; SMN2ALDH1A1TSHRHSD17B10
SCHEMBL1099125 0.95 LMNA (0.50) LMNASMN1; SMN2ALDH1A1TSHRHSD17B10
SCHEMBL308119 0.92 LMNA (0.54) LMNASMN1; SMN2ALDH1A1TSHRHSD17B10
SCHEMBL9156073 0.92 ALDH1A1 (0.43) LMNASMN1; SMN2ALDH1A1TSHRHSD17B10
SCHEMBL17526930 0.92 ALDH1A1 (0.43) LMNASMN1; SMN2ALDH1A1TSHRHSD17B10
SCHEMBL1433752 0.92 LMNA (0.48) LMNASMN1; SMN2ALDH1A1TSHRHSD17B10
SCHEMBL16548258 0.90 SMN1; SMN2 (0.52) LMNASMN1; SMN2ALDH1A1TSHRHSD17B10
SCHEMBL16897039 0.90 ALDH1A1 (0.52) LMNASMN1; SMN2ALDH1A1TSHRHSD17B10
SCHEMBL17526611 0.90 LMNA (0.58) LMNASMN1; SMN2ALDH1A1TSHRHSD17B10
SCHEMBL17526745 0.90 LMNA (0.58) LMNASMN1; SMN2ALDH1A1TSHRHSD17B10

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
US-5489630-A BLENDS OF POLY(ALKYLENE OXIDE)AMINE-EPOXY ADDUCT AND POLYEPOXIDES AIR PRODUCTS AND CHEMICALS, INC. (US) 1996-02-06 US disclosed