SCHEMBL4623915

SCHEMBL4623915

CCCCC1(S)NC(=O)NC1=O

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.38
MMP2 P08253 5/20 0.37
MMP9 P14780 5/20 0.37
MMP3 P08254 1/20 0.37
MMP13 P45452 4/20 0.36
MMP8 P22894 3/20 0.36
LMNA P02545 1/20 0.35
HSD17B10 Q99714 1/20 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
SCHEMBL1980043 0.94 MMP2 (0.42) TDP1MMP2MMP9MMP3MMP13
SCHEMBL4642996 0.88 LMNA (0.38) TDP1MMP2MMP9MMP3MMP13
SCHEMBL11583297 0.80 MMP14 (0.36) MMP13
SCHEMBL11581950 0.80 PYGB (0.31)
SCHEMBL11580974 0.79 LMNA (0.46) TDP1MMP2MMP9MMP3LMNA
SCHEMBL6331007 0.75 TDP1 (0.40) TDP1MMP2MMP9MMP3MMP13
SCHEMBL5272059 0.75 LMNA (0.43) MMP2MMP9MMP3MMP13MMP8
SCHEMBL6691265 0.73 SMN1; SMN2 (0.46) TDP1MMP2MMP9MMP3HSD17B10
SCHEMBL4620466 0.73 TDP1 (0.36) TDP1MMP2MMP9MMP3MMP13
SCHEMBL6692266 0.72 LMNA (0.40) TDP1MMP2MMP9MMP3MMP13

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1883454-A2 AGENT FOR PERMANENT HAIR WAVING CONTAINING HETEROCYCLIC MERCAPTO COMPOUND Showa Denko K.K. (JP) 2008-02-06 EP disclosed
WO-2006126729-A2 AGENT FOR PERMANENT HAIR WAVING CONTAINING HETEROCYCLIC MERCAPTO COMPOUND SHOWA DENKO K.K. (JP) 2006-11-30 WO disclosed
EP-0309310-A1 Enzymatic system, process for its preparation and its use, especially in the preparation of D-para-hydroxyphenyl glycine SOCIETE FRANCAISE HOECHST Société anonyme dite: (FR) 1989-03-29 EP disclosed