SCHEMBL5703207

SCHEMBL5703207

CCCCCCCCCCCC[C]1CCOC1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.33
TSHR P16473 1/20 0.33
SCD O00767 1/20 0.32
EPHX1 P07099 1/20 0.32
NOS1 P29475 1/20 0.32
NOS2 P35228 1/20 0.32
PTGS2 P35354 3/20 0.31
ESR1 P03372 2/20 0.31
ADRA2A P08913 2/20 0.31
ADORA3 P0DMS8 2/20 0.31
TACR2 P21452 2/20 0.31
SLC6A2 P23975 2/20 0.31
SLC6A4 P31645 2/20 0.31
SLC6A3 Q01959 2/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
SHBG P04278 1/20 0.31
TP53 P04637 1/20 0.31
CYP3A4 P08684 1/20 0.31

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
SCHEMBL28485150 0.82 TSHR (0.40) THRBTSHRSCDPTGS2ESR1
SCHEMBL10696783 0.80
SCHEMBL7866232 0.74 TSHR (0.47) THRBTSHRSCDPTGS2ESR1
SCHEMBL10983176 0.74 TSHR (0.47) THRBTSHRSCDPTGS2ESR1
SCHEMBL1896102 0.74 TSHR (0.47) THRBTSHRSCDPTGS2ESR1
SCHEMBL19468460 0.74 TSHR (0.47) THRBTSHRSCDPTGS2ESR1
SCHEMBL10866108 0.74 TSHR (0.47) THRBTSHRSCDPTGS2ESR1
SCHEMBL6244787 0.74 TSHR (0.47) THRBTSHRSCDPTGS2ESR1
SCHEMBL7739208 0.74 TSHR (0.47) THRBTSHRSCDPTGS2ESR1
SCHEMBL2579060 0.74 TSHR (0.47) THRBTSHRSCDPTGS2ESR1

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
WO-2021094458-A1 NOVEL BROAD RANGE BETA-LACTAMASES Centrient Pharmaceuticals Netherlands B.V. (NL) 2021-05-20 WO disclosed
EP-1272043-B1 LACTAMASE COMPOSITION FOR TREATMENT OF MILK FINNZYMES OY (FI) 2006-08-30 EP disclosed
EP-1272043-A1 ENZYME COMPOSITION FOR TREATMENT OF MILK Finnzymes Oy (FI) 2003-01-08 EP disclosed
WO-2001067879-A1 ENZYME COMPOSITION FOR TREATMENT OF MILK FINNZYMES OY (FI) 2001-09-20 WO disclosed
EP-1086120-A1 METHOD FOR PREPARING VIRUS-SAFE PHARMACEUTICAL COMPOSITIONS SUOMEN PUNAINEN RISTI VERIPALVELU (FI) 2001-03-28 EP disclosed
WO-1999064441-A1 METHOD FOR PREPARING VIRUS-SAFE PHARMACEUTICAL COMPOSITIONS SUOMEN PUNAINEN RISTI VERIPALVELU (FI) 1999-12-16 WO disclosed