SCHEMBL9791925

SCHEMBL9791925

CN(C)C(=O)c1ccc(C2[C@]3(O)C(O)C(c4ccc(C(N)=O)cc4)[C@]3(O)[C@]2(O)[C@H](O)CO)cc1

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL9791975 0.95 ALDH1A1 (0.35) ALDH1A1HPGDSMN1; SMN2
SCHEMBL9792042 0.88 EPHX2 (0.31) ALDH1A1HPGDSMN1; SMN2
SCHEMBL9792016 0.88 EPHX2 (0.31) ALDH1A1HPGDSMN1; SMN2
SCHEMBL9791934 0.86 PARP10 (0.45) ALDH1A1HPGDSMN1; SMN2
SCHEMBL9792085 0.85 PLK1 (0.32) HPGDSMN1; SMN2
SCHEMBL9791906 0.85 PLK1 (0.32) HPGDSMN1; SMN2
SCHEMBL9791989 0.84 ALDH1A1 (0.36) ALDH1A1HPGDSMN1; SMN2
SCHEMBL9791990 0.82 MLYCD (0.38) HPGD
SCHEMBL9791883 0.82 KDM4E (0.37) ALDH1A1HPGD
SCHEMBL9796151 0.82 KDM4E (0.37) ALDH1A1HPGD

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-4996334-A Dibenzylidenesorbitols for gelatinizing oils and liquids, increasing transparency and rigidity in resins, improving viscosity of coatings and stabilizing emulsions MITSUBISHI PETROCHEMICAL CO., LTD. (JP) 1991-02-26 US disclosed