SCHEMBL8467773

SCHEMBL8467773

C=C(CCCCC)OC(C)=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 4/20 0.48
CES1 P23141 4/20 0.48
AKR1B1 P15121 1/20 0.46
GPR84 Q9NQS5 7/20 0.44
PPARG P37231 7/20 0.44
PPARD Q03181 7/20 0.44
PPARA Q07869 7/20 0.44
HDAC11 Q96DB2 5/20 0.44
TSHR P16473 4/20 0.44
PTPN1 P18031 3/20 0.44
TDP1 Q9NUW8 3/20 0.44
ALDH1A1 P00352 2/20 0.44
TLR2 O60603 2/20 0.44
FABP4 P15090 2/20 0.44
HSD17B10 Q99714 2/20 0.44
SLC22A6 Q4U2R8 1/20 0.44
SLC22A8 Q8TCC7 1/20 0.44
MEN1 O00255 1/20 0.44
ESR1 P03372 1/20 0.44
ALOX15 P16050 1/20 0.44

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
SCHEMBL7024041 0.98 CES2 (0.50) CES2CES1GPR84PPARGPPARD
SCHEMBL218025 0.98 CES2 (0.50) CES2CES1GPR84PPARGPPARD
SCHEMBL4783263 0.98 CES2 (0.50) CES2CES1GPR84PPARGPPARD
SCHEMBL5318003 0.98 CES2 (0.50) CES2CES1GPR84PPARGPPARD
SCHEMBL27729873 0.98 CES2 (0.50) CES2CES1GPR84PPARGPPARD
SCHEMBL27709290 0.98 CES2 (0.50) CES2CES1GPR84PPARGPPARD
SCHEMBL27709375 0.98 CES2 (0.50) CES2CES1GPR84PPARGPPARD
SCHEMBL33222 0.93 CES1 (0.46) CES2CES1AKR1B1GPR84PPARG
SCHEMBL28907513 0.87 TERT (0.58) PPARGPPARDPPARAPTPN1TDP1
SCHEMBL1101179 0.85 CES2 (0.43) CES2CES1AKR1B1GPR84PPARG

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-5936048-A Method for preparing modified resins and their applications MITSUI CHEMICALS, INC. (JP) 1999-08-10 US disclosed
US-5792814-A REACTING A RESIN WITH A 5-((4,6-DIAMINO-S-TRIAZIN-2-YL)-NORBORN-2-ENE AND REACTING WITH AN EPOXIDE; FIREPROOFING; MOLDING MATERIALS MITSUI CHEMICALS, INC. (JP) 1998-08-11 US disclosed
US-5674947-A HEATING RESIN WITH FUNCTIONALIZED NORBORNENE COMPOUND IN ABSENCE OF REACTION CATALYST OR INITIATOR MITSUI TOATSU CHEMICALS, INC. (JP) 1997-10-07 US disclosed
US-4410710-A Conversion of iridoids to prostaglandins RESEARCH FOUNDATION OF THE CITY UNIVERSITY OF NEW YORK (US) 1983-10-18 US disclosed