SCHEMBL28211571

SCHEMBL28211571

CCOP(=O)(CC)C1CCCC1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.41
MMP1 P03956 1/20 0.38
MMP2 P08253 1/20 0.38
TP53 P04637 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
PPARD Q03181 2/20 0.31
ADRA2A P08913 1/20 0.30
NISCH Q9Y2I1 1/20 0.30

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
SCHEMBL575158 0.98 MMP1 (0.40) TSHRMMP1MMP2TP53TDP1
SCHEMBL28211569 0.80 HPGD (0.36) TSHRMMP1MMP2TP53TDP1
SCHEMBL23878221 0.80 CYP3A4 (0.47) TSHR
SCHEMBL575507 0.79 MMP1 (0.36) TSHRMMP1MMP2TP53TDP1
SCHEMBL575358 0.79 CYP3A4 (0.45) TSHR
SCHEMBL575422 0.78 ACHE (0.31) MMP1MMP2
SCHEMBL575213 0.77
SCHEMBL778187 0.77 MMP1 (0.36) TSHRMMP1MMP2
SCHEMBL575631 0.77 TSHR (0.42) TSHRMMP1MMP2TP53TDP1
SCHEMBL28011911 0.77 ACHE (0.31) MMP1MMP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107828207-A Fire retardant combination of stabilizers for thermoplastic polymer 科莱恩塑料和涂料有限公司 2018-03-23 CN claimed
CN-107828207-A Fire retardant combination of stabilizers for thermoplastic polymer 科莱恩塑料和涂料有限公司 2018-03-23 CN disclosed