SCHEMBL7554607

SCHEMBL7554607

CCCCCOC(=O)[C@@H](N)CSC(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 19/20 0.61
DNMT1 P26358 1/20 0.53

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
SCHEMBL8127147 0.85 KIF11 (0.67) KIF11DNMT1
SCHEMBL9135894 0.85 KIF11 (0.67) KIF11DNMT1
SCHEMBL15662531 0.82 KIF11 (0.70) KIF11DNMT1
SCHEMBL3439368 0.81 KIF11 (0.85) KIF11DNMT1
SCHEMBL12872399 0.81 KIF11 (0.85) KIF11DNMT1
SCHEMBL9137501 0.81 KIF11 (0.85) KIF11DNMT1
Hydrochloric Acid SCHEMBL13736621 0.80 KIF11 (0.82) KIF11DNMT1
Hydrochloric Acid SCHEMBL29401160 0.80 KIF11 (0.82) KIF11DNMT1
SCHEMBL29635035 0.79 KIF11 (0.65) KIF11DNMT1
SCHEMBL5996941 0.79 KIF11 (0.65) KIF11DNMT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1183237-A1 NOVEL ANTIOXIDANTS, PREPARATION METHODS AND USES CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2002-03-06 EP claimed
WO-2000073266-A1 NOVEL ANTIOXIDANTS, PREPARATION METHODS AND USES CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2000-12-07 WO claimed
WO-2022190486-A1 SILANE-CONTAINING CONDENSED CYCLIC DIPEPTIDE COMPOUND, PRODUCTION METHOD THEREFOR, AND METHOD FOR PRODUCING POLYPEPTIDE COMPOUND USING SAME 学校法人中部大学 2022-09-15 WO disclosed
EP-1183237-A1 NOVEL ANTIOXIDANTS, PREPARATION METHODS AND USES CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2002-03-06 EP disclosed
WO-2000073266-A1 NOVEL ANTIOXIDANTS, PREPARATION METHODS AND USES CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2000-12-07 WO disclosed