SCHEMBL6675223

SCHEMBL6675223

O=C(C(=O)c1ccc(C#Cc2ccccc2)cc1)c1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CES2 O00748 8/20 0.68
CES1 P23141 7/20 0.68
APP P05067 1/20 0.55
FFAR1 O14842 4/20 0.53
GRM5 P41594 2/20 0.50
RAB9A P51151 1/20 0.50
FFAR4 Q5NUL3 1/20 0.50
MMP2 P08253 1/20 0.49
MMP9 P14780 1/20 0.49
MMP12 P39900 1/20 0.49
MMP14 P50281 1/20 0.49
MMP15 P51511 1/20 0.49
MMP16 P51512 1/20 0.49
MMP26 Q9NRE1 1/20 0.49
VCP P55072 1/20 0.48

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
SCHEMBL3753633 0.98 CES2 (0.64) CES2CES1APPFFAR1GRM5
SCHEMBL2336741 0.98 CES2 (0.71) CES2CES1APPFFAR1GRM5
SCHEMBL4190711 0.92 CES2 (0.58) CES2CES1APPFFAR1GRM5
SCHEMBL4196818 0.88 CES2 (0.52) CES2CES1APPFFAR1GRM5
SCHEMBL1744898 0.86 ALDH1A1 (0.64) APPFFAR1GRM5RAB9AFFAR4
SCHEMBL13567253 0.86 FFAR1 (0.56) CES2CES1FFAR1
SCHEMBL14584313 0.86 FFAR1 (0.56) CES2CES1FFAR1
SCHEMBL13567255 0.86 FFAR1 (0.56) CES2CES1FFAR1
SCHEMBL4848452 0.85 CES2 (0.56) CES2CES1APPFFAR1RAB9A
SCHEMBL402518 0.84 RARB (0.62) CES2CES1APPFFAR1GRM5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1170279-B1 Polyphenylene oligomers and polymers DOW GLOBAL TECHNOLOGIES INC (US) 2004-09-29 EP disclosed
EP-0889920-B1 POLYPHENYLENE OLIGOMERS AND POLYMERS DOW CHEMICAL CO (US) 2002-02-13 EP disclosed
EP-1170279-A1 Polyphenylene oligomers and polymers THE DOW CHEMICAL COMPANY (US) 2002-01-09 EP disclosed
US-6288188-B1 ACETYLENIC POLYMERS; INTEGRATED CIRCUITS, DIELECTRICS, MICROELECTRONICS THE DOW CHEMICAL COMPANY 2001-09-11 US disclosed
US-5965679-A BASED A BISCYCLOPENTADIENONE AND AN AROMATIC DIACETYLENE; CURING; LOW DIELECTRIC; INTEGRATED CIRCUITS; MICROELECTRONICS; PRINTED CIRCUITS THE DOW CHEMICAL COMPANY (US) 1999-10-12 US disclosed
EP-0889920-A1 POLYPHENYLENE OLIGOMERS AND POLYMERS THE DOW CHEMICAL COMPANY (US) 1999-01-13 EP disclosed
WO-1998011149-A1 POLYPHENYLENE OLIGOMERS AND POLYMERS THE DOW CHEMICAL COMPANY (US) 1998-03-19 WO disclosed