SCHEMBL1872168

SCHEMBL1872168

CCCCCCCCOc1ccsc1-c1nc2sc(-c3sccc3OCCCCCCCC)nc2s1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 2/20 0.38
TLR8 Q9NR97 2/20 0.38
MEN1 O00255 1/20 0.35
NR1I2 O75469 1/20 0.35
LMNA P02545 1/20 0.35
CHRM2 P08172 1/20 0.35
CYP3A4 P08684 1/20 0.35
ADRA2A P08913 1/20 0.35
MAPT P10636 1/20 0.35
OPRK1 P41145 1/20 0.35
HTR2B P41595 1/20 0.35
SLC6A3 Q01959 1/20 0.35
KMT2A Q03164 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
NR5A1 Q13285 1/20 0.34
SMPD1 P17405 3/20 0.33
PDE5A O76074 1/20 0.33
PDE4A P27815 1/20 0.33
PDE4B Q07343 1/20 0.33
PDE4C Q08493 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
SCHEMBL13561136 0.94 ALDH1A1 (0.35) MCHR1TLR8MEN1NR1I2LMNA
SCHEMBL5133914 0.83 NR5A1 (0.43) MCHR1TLR8MEN1NR1I2LMNA
SCHEMBL1279017 0.83 NR5A1 (0.43) MCHR1TLR8MEN1NR1I2LMNA
SCHEMBL3103832 0.83 NR5A1 (0.43) MCHR1TLR8MEN1NR1I2LMNA
SCHEMBL8520184 0.81 MAPT (0.40) MCHR1TLR8MEN1NR1I2LMNA
SCHEMBL1868805 0.81 MCHR1 (0.34) MCHR1TLR8MEN1MAPTKMT2A
SCHEMBL586546 0.77 KCNH2 (0.38) TLR8MEN1CYP3A4MAPTKMT2A
SCHEMBL15400588 0.77 KCNH2 (0.38) TLR8MEN1CYP3A4MAPTKMT2A
SCHEMBL10301449 0.77 KCNH2 (0.38) TLR8MEN1CYP3A4MAPTKMT2A
SCHEMBL371994 0.77 KCNH2 (0.38) TLR8MEN1CYP3A4MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8871884-B2 Copolymer semiconductors comprising thiazolothiazole or benzobisthiazole, or benzobisoxazole electron acceptor subunits, and electron donor subunits, and their uses in transistors and solar cells UNIVERSITY OF WASHINGTON (US) 2014-10-28 US disclosed
US-20120273732-A1 COPOLYMER SEMICONDUCTORS COMPRISING THIAZOLOTHIAZOLE OR BENZOBISTHIAZOLE, OR BENZOBISOXAZOLE ELECTRON ACCEPTOR SUBUNITS, AND ELECTRON DONOR SUBUNITS, AND THEIR USES IN TRANSISTORS AND SOLAR CELLS UNIVERSITY OF WASHINGTON 2012-11-01 US disclosed
EP-2493960-A1 COPOLYMER SEMICONDUCTORS COMPRISING THIAZOLOTHIAZOLE OR BENZOBISTHIAZOLE, OR BENZOBISOXAZOLE ELECTRON ACCEPTOR SUBUNITS, AND ELECTRON DONOR SUBUNITS, AND THEIR USES IN TRANSISTORS AND SOLAR CELLS University Of Washington (US) 2012-09-05 EP disclosed
WO-2011051292-A1 COPOLYMER SEMICONDUCTORS COMPRISING THIAZOLOTHIAZOLE OR BENZOBISTHIAZOLE, OR BENZOBISOXAZOLE ELECTRON ACCEPTOR SUBUNITS, AND ELECTRON DONOR SUBUNITS, AND THEIR USES IN TRANSISTORS AND SOLAR CELLS UNIVERSITY OF WASHINGTON (US) 2011-05-05 WO disclosed