SCHEMBL27959617

SCHEMBL27959617

CCOC(OCC)(P=O)C(=O)O

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 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
SCHEMBL7367474 0.69 ALDH1A1 (0.36) ALDH1A1
SCHEMBL31357004 0.69 ALDH1A1 (0.36) ALDH1A1
SCHEMBL5947964 0.69 ALDH1A1 (0.36) ALDH1A1
SCHEMBL4574677 0.69 CYP2D6 (0.36) ALDH1A1
SCHEMBL28427892 0.68
SCHEMBL26380 0.67 ALDH1A1 (0.38) ALDH1A1
SCHEMBL642729 0.67
SCHEMBL5947966 0.67 ALDH1A1 (0.38) ALDH1A1
SCHEMBL8950672 0.67 ALDH1A1 (0.33) ALDH1A1
SCHEMBL10435582 0.66 ALDH1A1 (0.38) ALDH1A1

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-102093421-B Phosphorus substituent group-containing quinoline compound and preparation method of quinoline compound as well as pharmaceutical composition containing quinoline compound and application of pharmaceutical composition GUANGZHOU YINGSHENG BIO TECHNOLOGY CO LTD 2014-07-02 CN disclosed