SCHEMBL697379

SCHEMBL697379

CCCCCCCCOc1cccc(-c2nc(OC)nc(-c3ccccc3)n2)c1OCCCCCCCC

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 2/20 0.39
PDE4A P27815 2/20 0.39
PDE4B Q07343 2/20 0.39
PDE4C Q08493 2/20 0.39
PDE4D Q08499 2/20 0.39
MCHR1 Q99705 2/20 0.39
THRA P10827 1/20 0.39
THRB P10828 1/20 0.39
SOAT1 P35610 1/20 0.39
PTPN11 Q06124 2/20 0.38
PTPN1 P18031 1/20 0.38
DHPS P49366 1/20 0.37
TLR8 Q9NR97 1/20 0.37
DPP4 P27487 1/20 0.37
KDM4E B2RXH2 1/20 0.37
BCHE P06276 1/20 0.36
ACHE P22303 1/20 0.36
MEN1 O00255 1/20 0.36
NR1I2 O75469 1/20 0.36
LMNA P02545 1/20 0.36

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
SCHEMBL5917803 0.84 NPSR1 (0.46) THRBDHPSDPP4KDM4EMEN1
SCHEMBL6399457 0.82 SOAT1 (0.37) THRATHRBSOAT1PTPN11PTPN1
SCHEMBL27875103 0.80 SOAT1 (0.50) THRATHRBSOAT1PTPN1TLR8
SCHEMBL27938548 0.80 KDM4E (0.49) MCHR1THRATHRBSOAT1PTPN11
SCHEMBL9068422 0.80 KDM4E (0.49) MCHR1THRATHRBSOAT1PTPN11
SCHEMBL28780749 0.79 KDM4E (0.50) THRATHRBSOAT1PTPN11PTPN1
SCHEMBL6054722 0.78 PTPN11 (0.46) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL10597509 0.78 PTPN11 (0.49) MCHR1THRATHRBSOAT1PTPN11
SCHEMBL10596912 0.78 PTPN11 (0.49) MCHR1THRATHRBSOAT1PTPN11
SCHEMBL10597744 0.78 PTPN11 (0.49) MCHR1THRATHRBSOAT1PTPN11

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-8815218-B2 Cosmetic or dermatological preparation DR. STRAETMANS GMBH (DE) 2014-08-26 US disclosed
US-20120128610-A1 COSMETIC OR DERMATOLOGICAL PREPARATION EVONIK OPERATIONS GMBH (DE) 2012-05-24 US disclosed
EP-2421614-A1 COSMETIC OR DERMATOLOGICAL PREPARATION Dr. Straetmans GmbH (DE) 2012-02-29 EP disclosed
WO-2010121759-A1 COSMETIC OR DERMATOLOGICAL PREPARATION DR. STRAETMANS GMBH (DE) 2010-10-28 WO disclosed
EP-1723944-A1 Cosmetic and dermatological sunscreens comprising chemical UV-screens and glyceryl triheptanoate Dr. Streatmans Chemische Produktion GmbH (DE) 2006-11-22 EP disclosed