SCHEMBL2582382

SCHEMBL2582382

CCCCCCCCC#Cc1ccsc1

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 2/20 0.46
FFAR1 O14842 1/20 0.46
FFAR4 Q5NUL3 1/20 0.46
MMP2 P08253 1/20 0.44
MMP12 P39900 1/20 0.44
GRM5 P41594 1/20 0.38
GPR84 Q9NQS5 1/20 0.37
CYP2A6 P11509 1/20 0.37

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
SCHEMBL3484316 1.00 KCNH2 (0.46) KCNH2FFAR1FFAR4MMP2MMP12
SCHEMBL11008049 0.81 MEN1 (0.49) GRM5CYP2A6
SCHEMBL5886652 0.79 FFAR1 (0.63) KCNH2FFAR1FFAR4MMP2MMP12
SCHEMBL8864048 0.78 FFAR1 (0.48) FFAR1FFAR4MMP2MMP12
SCHEMBL17545139 0.77
SCHEMBL4071200 0.74 FFAR1 (0.58) KCNH2FFAR1FFAR4MMP2MMP12
SCHEMBL4073903 0.74 FFAR1 (0.58) KCNH2FFAR1FFAR4MMP2MMP12
SCHEMBL9015870 0.74 FFAR1 (0.58) KCNH2FFAR1FFAR4MMP2MMP12
SCHEMBL7139040 0.74 FFAR1 (0.58) KCNH2FFAR1FFAR4MMP2MMP12
SCHEMBL2350387 0.74 FFAR1 (0.58) KCNH2FFAR1FFAR4MMP2MMP12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070238852-A1 Poly(alkynylthiophenes)s XEROX CORPORATION 2007-10-11 US claimed
US-20070235719-A1 Poly(alkynylthiophene)s and electronic devices generated therefrom XEROX CORPORATION 2007-10-11 US claimed
EP-1843409-A2 Poly(Alkynylthiophene)s and electronic devices generated therefrom Xerox Corporation (US) 2007-10-10 EP claimed
CN-101050267-A Poly(alkynylthiophene)s and electronic devices generated therefrom XEROX CORP (US) 2007-10-10 CN claimed
EP-1843409-B1 Organic thin film transistor comprising a poly(ethynylthiophene) XEROX CORP (US) 2015-05-13 EP disclosed
US-8049205-B2 Poly(alkynylthiophene)s and electronic devices generated therefrom XEROX CORPORATION (US) 2011-11-01 US disclosed
US-7705111-B2 Poly(alkynylthiophene)s XEROX CORPORATION (US) 2010-04-27 US disclosed
US-20070238852-A1 Poly(alkynylthiophenes)s XEROX CORPORATION 2007-10-11 US disclosed
US-20070235719-A1 Poly(alkynylthiophene)s and electronic devices generated therefrom XEROX CORPORATION 2007-10-11 US disclosed
EP-1843409-A2 Poly(Alkynylthiophene)s and electronic devices generated therefrom Xerox Corporation (US) 2007-10-10 EP disclosed
CN-101050267-A Poly(alkynylthiophene)s and electronic devices generated therefrom XEROX CORP (US) 2007-10-10 CN disclosed