SCHEMBL5053405

SCHEMBL5053405

C=C(CCCC)C(=O)O.[PoH2]

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES1 P23141 2/20 0.48
CES2 O00748 1/20 0.48
ALDH1A1 P00352 3/20 0.44
AKR1B1 P15121 1/20 0.44
TP53 P04637 1/20 0.44
THRB P10828 1/20 0.43
FNTA P49354 1/20 0.43
FNTB P49356 1/20 0.43
PGGT1B P53609 1/20 0.43
GPR84 Q9NQS5 7/20 0.42
PPARG P37231 7/20 0.42
PPARD Q03181 7/20 0.42
PPARA Q07869 7/20 0.42
HDAC11 Q96DB2 5/20 0.42
TSHR P16473 4/20 0.42
PTPN1 P18031 3/20 0.42
TLR2 O60603 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
FABP4 P15090 2/20 0.42
SLC22A6 Q4U2R8 1/20 0.42

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
SCHEMBL6916130 0.97 CES1 (0.50) CES1CES2ALDH1A1AKR1B1TP53
SCHEMBL22623 0.97
SCHEMBL11501485 0.95 CES1 (0.48) CES1CES2ALDH1A1AKR1B1TP53
SCHEMBL29143542 0.95 CES1 (0.48) CES1CES2ALDH1A1AKR1B1TP53
Ethylene SCHEMBL586620 0.95 CES1 (0.48) CES1CES2ALDH1A1AKR1B1TP53
SCHEMBL2578200 0.95 CES1 (0.48) CES1CES2ALDH1A1AKR1B1TP53
Ethylene SCHEMBL7561864 0.95 CES1 (0.48) CES1CES2ALDH1A1AKR1B1TP53
Bromide SCHEMBL30933210 0.95 CES1 (0.48) CES1CES2ALDH1A1AKR1B1TP53
Hydrochloric Acid SCHEMBL9902114 0.95 CES1 (0.48) CES1CES2ALDH1A1AKR1B1TP53
Ethane SCHEMBL27618955 0.95 CES1 (0.48) CES1CES2ALDH1A1AKR1B1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7374849-B2 Coated carrier XEROX CORPORATION (US) 2008-05-20 US disclosed
EP-1701219-A2 Carrier and Developer Compositions Xerox Corporation (US) 2006-09-13 EP disclosed
US-20060199094-A1 Carrier and developer compositions XEROX CORPORATION 2006-09-07 US disclosed
US-20060166125-A1 Coated carrier XEROX CORPORATION 2006-07-27 US disclosed
US-7014971-B2 For developers; first carrier is comprised of a steel core and the second carrier is comprised of a magnetite; wide range of a preselected conductivity and a wide range of preselected triboelectric charging values XEROX CORPORATION (US) 2006-03-21 US disclosed
US-20040180281-A1 Carrier compositions XEROX CORPORATION 2004-09-16 US disclosed
US-20030022089-A1 CARRIER PARTICLES XEROX CORPORATION. 2003-01-30 US disclosed
US-6511780-B1 Developers that can be selected for development of images in electrostatographic, especially xerographic, imaging systems, printing processes and digital systems XEROX CORPORATION 2003-01-28 US disclosed