SCHEMBL27699147

SCHEMBL27699147

CCCCCCC(CC)OCC1CO1

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.51
TDP1 Q9NUW8 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.46
ENPP2 Q13822 3/20 0.37
LPAR2 Q9HBW0 2/20 0.37
EPHX1 P07099 1/20 0.35
SPHK1 Q9NYA1 1/20 0.35
TSHR P16473 1/20 0.34

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
SCHEMBL27849547 1.00 ALDH1A1 (0.51) ALDH1A1TDP1SMN1; SMN2ENPP2LPAR2
SCHEMBL10441100 1.00 ALDH1A1 (0.51) ALDH1A1TDP1SMN1; SMN2ENPP2LPAR2
SCHEMBL29269134 1.00 ALDH1A1 (0.51) ALDH1A1TDP1SMN1; SMN2ENPP2LPAR2
SCHEMBL27315422 0.98 ALDH1A1 (0.50) ALDH1A1TDP1SMN1; SMN2ENPP2LPAR2
SCHEMBL240264 0.98 ALDH1A1 (0.50) ALDH1A1TDP1SMN1; SMN2ENPP2LPAR2
SCHEMBL1931230 0.93 ALDH1A1 (0.55) ALDH1A1TDP1SMN1; SMN2ENPP2LPAR2
SCHEMBL3388101 0.93 ALDH1A1 (0.55) ALDH1A1TDP1SMN1; SMN2ENPP2LPAR2
SCHEMBL31194891 0.93 ALDH1A1 (0.55) ALDH1A1TDP1SMN1; SMN2ENPP2LPAR2
SCHEMBL28151172 0.93 ALDH1A1 (0.55) ALDH1A1TDP1SMN1; SMN2ENPP2LPAR2
SCHEMBL27660715 0.93 ALDH1A1 (0.56) ALDH1A1TDP1SMN1; SMN2ENPP2LPAR2

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
CN-101163731-A Processes using alpha, omega-difunctional aldaramides as monomers and crosslinkers DU PONT (US) 2008-04-16 CN disclosed