SCHEMBL5666709

SCHEMBL5666709

CCCCCCCCCc1ccc(-c2cccc(C(C)C)c2O)c(-n2nc3ccc(C(F)(F)F)cc3n2)c1

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTPN5 P54829 1/20 0.35
S1PR4 O95977 5/20 0.35
S1PR1 P21453 5/20 0.35
TRPV1 Q8NER1 1/20 0.34
PLK1 P53350 1/20 0.34
S1PR5 Q9H228 4/20 0.33
MC4R P32245 2/20 0.33
GPR3 P46089 1/20 0.32
HSD11B1 P28845 1/20 0.32
EIF4A1 P60842 1/20 0.32

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
SCHEMBL5666240 0.89 PTPN5 (0.37) PTPN5MC4R
SCHEMBL30776957 0.80 PTPN5 (0.35) PTPN5
SCHEMBL29175703 0.80 PTPN5 (0.35) PTPN5
SCHEMBL5834556 0.80 KAT8 (0.41) S1PR4S1PR1TRPV1PLK1S1PR5
SCHEMBL27466288 0.76 NPC1 (0.39) TRPV1PLK1EIF4A1
SCHEMBL29175702 0.74 HSP90AA1 (0.35) PTPN5
SCHEMBL2638154 0.73 TRPV1 (0.38) S1PR4S1PR1TRPV1PLK1S1PR5
SCHEMBL5873319 0.73 TRPV1 (0.38) S1PR4S1PR1TRPV1PLK1S1PR5
SCHEMBL27480898 0.72 PLK1 (0.34) S1PR4S1PR1TRPV1PLK1S1PR5
SCHEMBL13700441 0.72 KDM4E (0.33) MC4R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1175467-B1 STABILIZED ADHESIVE COMPOSITIONS CONTAINING HIGHLY SOLUBLE, RED-SHIFTED, PHOTOSTABLE BENZOTRIAZOLE UV ABSORBERS AND LAMINATED ARTICLES DERIVED THEREFROM CIBA SC HOLDING AG (CH) 2006-06-14 EP claimed