SCHEMBL2206803

SCHEMBL2206803

NC(=S)CCCCCCCCO

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.43
FFAR1 O14842 1/20 0.43
FFAR4 Q5NUL3 1/20 0.43
LMNA P02545 2/20 0.36
ALDH1A1 P00352 1/20 0.36
HSD17B10 Q99714 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
TSHR P16473 1/20 0.36
CA1 P00915 3/20 0.36
CA2 P00918 3/20 0.36
CA12 O43570 2/20 0.36
CA9 Q16790 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
KDM4E B2RXH2 1/20 0.36
GAA P10253 1/20 0.34
MIF P14174 1/20 0.33
FNTA P49354 1/20 0.33
FNTB P49356 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
SCHEMBL2206084 1.00
SCHEMBL2206691 1.00 GPR84 (0.43) GPR84FFAR1FFAR4LMNAALDH1A1
SCHEMBL2205997 1.00 GPR84 (0.43) GPR84FFAR1FFAR4LMNAALDH1A1
SCHEMBL2205259 1.00 GPR84 (0.43) GPR84FFAR1FFAR4LMNAALDH1A1
SCHEMBL2202086 0.97
SCHEMBL2205406 0.88
SCHEMBL12019019 0.87 TSHR (0.36) LMNAALDH1A1MEN1KMT2ATSHR
SCHEMBL11854035 0.87 TSHR (0.36) LMNAALDH1A1MEN1KMT2ATSHR
SCHEMBL2208010 0.84 TSHR (0.39) TSHR
SCHEMBL2205880 0.81

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
US-8273412-B2 Method for applying corrosion protection layers comprising thioamides to metallic surfaces BASF AKTIENGESELLSCHAFT (DE) 2012-09-25 US claimed
US-8273412-B2 Method for applying corrosion protection layers comprising thioamides to metallic surfaces BASF AKTIENGESELLSCHAFT (DE) 2012-09-25 US disclosed
US-7981954-B2 Anti-corrosion coatings containing thioamide groups BASF AKTIENGESELLSCHAFT (DE) 2011-07-19 US disclosed
US-20090156736-A1 ANTI-CORROSION COATINGS CONTAINING THIOAMIDE GROUPS BASF AKTIENGESELLSCHAFT (DE) 2009-06-18 US disclosed
US-20080131687-A1 Method For Applying Corrosion Protection Layers Comprising Thioamides To Metallic Surfaces BASF AKTIENGESELLSCHAFT (DE) 2008-06-05 US disclosed