SCHEMBL27671127

SCHEMBL27671127

N[C@H]1C(OC(=O)c2ccccc2)O[C@H](CO)[C@H](O)[C@@H]1O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LGALS9 O00182 3/20 0.56
LGALS1 P09382 3/20 0.56
LGALS3 P17931 3/20 0.56
LGALS7; LGALS7B P47929 2/20 0.56
MAOB P27338 1/20 0.51
PYGL P06737 1/20 0.44
SYNJ2 O15056 2/20 0.43
LGALS8 O00214 1/20 0.43
KDM4E B2RXH2 1/20 0.43
ABL1 P00519 1/20 0.43
ALPL P05186 1/20 0.43
POLB P06746 1/20 0.43
ALPI P09923 1/20 0.43
GAA P10253 1/20 0.43
MAPT P10636 1/20 0.43
ALPG P10696 1/20 0.43
PABPC1 P11940 1/20 0.43
RECQL P46063 1/20 0.43
GALK1 P51570 1/20 0.43
CASP7 P55210 1/20 0.43

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
SCHEMBL27689819 1.00 LGALS9 (0.56) LGALS9LGALS1LGALS3LGALS7; LGALS7BMAOB
SCHEMBL27671166 1.00 LGALS9 (0.56) LGALS9LGALS1LGALS3LGALS7; LGALS7BMAOB
SCHEMBL27639803 0.89 LGALS9 (0.61) LGALS9LGALS1LGALS3LGALS7; LGALS7BMAOB
SCHEMBL6570199 0.89 LGALS9 (0.61) LGALS9LGALS1LGALS3LGALS7; LGALS7BMAOB
SCHEMBL28162884 0.89 LGALS9 (0.61) LGALS9LGALS1LGALS3LGALS7; LGALS7BMAOB
SCHEMBL6507790 0.89 LGALS9 (0.61) LGALS9LGALS1LGALS3LGALS7; LGALS7BMAOB
SCHEMBL6570202 0.89 LGALS9 (0.61) LGALS9LGALS1LGALS3LGALS7; LGALS7BMAOB
SCHEMBL7144990 0.89 LGALS9 (0.61) LGALS9LGALS1LGALS3LGALS7; LGALS7BMAOB
SCHEMBL7141014 0.89 LGALS9 (0.61) LGALS9LGALS1LGALS3LGALS7; LGALS7BMAOB
SCHEMBL7138693 0.89 LGALS9 (0.61) LGALS9LGALS1LGALS3LGALS7; LGALS7BMAOB

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-85107911-A The production method of ellipticine derivative 1987-02-25 CN disclosed