SCHEMBL10488689

SCHEMBL10488689

COC(=O)CCCCCCCCO[C@H]1O[C@@H]2COC(c3ccccc3)O[C@@H]2[C@H](O)[C@H]1NC(C)=O

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 3/20 0.55
▸ KMT2A Q03164 3/20 0.53
▸ MEN1 O00255 2/20 0.51
▸ ALDH1A1 P00352 3/20 0.49
▸ PKM P14618 1/20 0.49
▸ MAPK1 P28482 1/20 0.40
▸ SELP P16109 1/20 0.37
▸ LGALS8 O00214 1/20 0.35
▸ LGALS3 P17931 1/20 0.35
▸ LGALS4 P56470 1/20 0.35
▸ GAA P10253 1/20 0.34
▸ B4GALT1 P15291 1/20 0.33
▸ TLR2 O60603 4/20 0.33
▸ TLR1 Q15399 4/20 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
SCHEMBL7152277 1.00 L3MBTL1 (0.55) L3MBTL1KMT2AMEN1ALDH1A1PKM
SCHEMBL7150744 1.00 L3MBTL1 (0.55) L3MBTL1KMT2AMEN1ALDH1A1PKM
SCHEMBL8831098 0.91 L3MBTL1 (0.56) L3MBTL1KMT2AMEN1ALDH1A1PKM
SCHEMBL11094885 0.91 L3MBTL1 (0.51) L3MBTL1KMT2AMEN1ALDH1A1PKM
SCHEMBL11419924 0.89 KMT2A (0.62) L3MBTL1KMT2AMEN1ALDH1A1PKM
SCHEMBL9472687 0.89 KMT2A (0.62) L3MBTL1KMT2AMEN1ALDH1A1PKM
SCHEMBL15508270 0.88 L3MBTL1 (0.59) L3MBTL1KMT2AMEN1ALDH1A1PKM
SCHEMBL10333863 0.87 L3MBTL1 (0.54) L3MBTL1KMT2AMEN1ALDH1A1PKM
SCHEMBL14355283 0.87 L3MBTL1 (0.54) L3MBTL1KMT2AMEN1ALDH1A1PKM
SCHEMBL14355284 0.86 L3MBTL1 (0.56) L3MBTL1KMT2AMEN1ALDH1A1PKM

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4866041-A HYPERSENSITIVE TO PRESENCE OF CANCER CELLS; GALACTOPYRANOSIDES CHEMBIOMED, LTD. (CA) 1989-09-12 — — US disclosed
US-4855126-A 2-ACETAMIDO-2-DEOXY-3-O-(D-GALACTOPYRANOSY)-D-GALACTO -PYRANOSIDE/ CHEMBIOMED LTD. (CA) 1989-08-08 — — US disclosed
US-4794176-A HAPTEN DISACCHARIDE FOR CANCER DIAGNOSIS CHEMBIOMED (CA) 1988-12-27 — — US disclosed
US-4767845-A DIAGNOSTIC FOR HUMAN CANCER; GLYCOSIDES BY REDUCTION, ACETYLATION, DEACETYLATION CHEMBIOMED, LTD. (CA) 1988-08-30 — — US disclosed
EP-0044188-B1 SYNTHESIS OF TUMOR ANTIGENIC DETERMINANT CHEMBIOMED LTD. (CA) 1986-05-28 — — EP disclosed
EP-0044188-A2 Synthesis of tumor antigenic determinant CHEMBIOMED LTD. (CA) 1982-01-20 — — EP disclosed
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