SCHEMBL6257380

SCHEMBL6257380

CCCCC(=O)OSc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CES2 O00748 4/20 0.50
CES1 P23141 4/20 0.50
KDM4E B2RXH2 2/20 0.50
MEN1 O00255 1/20 0.50
RECQL P46063 1/20 0.50
KMT2A Q03164 1/20 0.50
NPSR1 Q6W5P4 1/20 0.41
L3MBTL1 Q9Y468 3/20 0.40
ALDH1A1 P00352 2/20 0.40
CETP P11597 1/20 0.40
PTGS2 P35354 1/20 0.40
LMNA P02545 2/20 0.39
PAX8 Q06710 1/20 0.39
POLB P06746 1/20 0.39
ATM Q13315 1/20 0.39
TDP1 Q9NUW8 3/20 0.39
TSHR P16473 1/20 0.39
CRHBP P24387 1/20 0.38
CRHR2 Q13324 1/20 0.38

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
SCHEMBL7829859 0.93 CES2 (0.53) CES2CES1KDM4EMEN1RECQL
SCHEMBL6753538 0.89 CES2 (0.47) CES2CES1KDM4EMEN1RECQL
SCHEMBL29974108 0.82 CES2 (0.44) CES2CES1KDM4EMEN1KMT2A
SCHEMBL11263922 0.81 SMN1; SMN2 (0.43) CES2CES1KDM4EMEN1RECQL
SCHEMBL15361916 0.77 FFAR1 (0.43) L3MBTL1ALDH1A1TDP1
SCHEMBL535803 0.76 LMNA (0.50) KDM4EMEN1RECQLKMT2AL3MBTL1
SCHEMBL25600274 0.76 ALDH1A1 (0.51) KDM4EMEN1RECQLKMT2AL3MBTL1
SCHEMBL10504820 0.74 CES2 (0.52) CES2CES1KDM4EMEN1RECQL
SCHEMBL28317770 0.74 KDM4E (0.51) CES2CES1KDM4EMEN1RECQL
SCHEMBL27622014 0.74 HSD17B3 (0.47) CES2CES1KMT2AALDH1A1LMNA

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
EP-1579276-A1 NOVEL POLYHYDROXYALKANOATE HAVING AMIDE, SULFONIC ACID OR SULFONATE ESTER GROUP, CHARGE CONTROL AGENT AND TONER CANON KABUSHIKI KAISHA (JP) 2005-09-28 EP disclosed
WO-2004061529-A1 NOVEL POLYHYDROXYALKANOATE HAVING AMIDE, SULFONIC ACID OR SULFONATE ESTER GROUP, CHARGE CONTROL AGENT AND TONER CANON KABUSHIKI KAISHA (JP) 2004-07-22 WO disclosed
WO-2004041905-A1 NEW POLYHYDROXYALKANOATE COPOLYMER, RESIN COMPOSITION, MOLDED PRODUCT, TONER, IMAGE FORMING METHOD AND IMAGE FORMING APPARATUS CANON KABUSHIKI KAISHA (JP) 2004-05-21 WO disclosed
WO-2004037889-A1 POLYHYDROXYALKANOATE, PROCESS FOR PREPARING THE SAME, AND RESIN COMPOSITION CONTAINING THE POLYHYDROXYALKANOATE CANON KABUSHIKI KAISHA (JP) 2004-05-06 WO disclosed