SCHEMBL5873442

SCHEMBL5873442

O=C(O)C1(C(=O)O)CCCCC1=O

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
AKR1C1 Q04828 1/20 0.34
CYP2C19 P33261 1/20 0.32
HDAC4 P56524 1/20 0.31
LMNA P02545 1/20 0.31
TSHR P16473 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31

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
Ethane SCHEMBL908993 0.96 AKR1C1 (0.32) AKR1C1CYP2C19LMNA
SCHEMBL8047121 0.84 DGAT1 (0.33) AKR1C1
SCHEMBL8047242 0.80 DGAT1 (0.33)
SCHEMBL15658483 0.79 HTT (0.35) LMNATSHR
SCHEMBL6092886 0.78 SMN1; SMN2 (0.42) CYP2C19TSHRNPSR1
SCHEMBL15657353 0.74 MCL1 (0.41) AKR1C1HDAC4LMNA
SCHEMBL3170 0.73 FFAR3 (0.37) AKR1C1CYP2C19LMNA
SCHEMBL14941423 0.73 CYP2C19 (0.34) AKR1C1CYP2C19HDAC4TSHR
SCHEMBL15658504 0.71 CYP2C9 (0.36) CYP2C19TSHR
SCHEMBL8078206 0.71 FFAR3 (0.36) AKR1C1CYP2C19HDAC4LMNA

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-6989052-B1 Phase change ink printing process XEROX CORPORATION (US) 2006-01-24 US claimed
US-20160071992-A1 BACK SHEET FOR SOLAR CELLS AND SOLAR CELL MODULE FUJIFILM CORPORATION (JP) 2016-03-10 US disclosed
EP-0983149-A1 PLANOGRAPHIC PRINTING Kodak Polychrome Graphics Company Ltd. (US) 2000-03-08 EP disclosed
WO-1998052767-A1 PLANOGRAPHIC PRINTING KODAK POLYCHROME GRAPHICS COMPANY LTD. (US) 1998-11-26 WO disclosed