SCHEMBL7108995

SCHEMBL7108995

Cc1ccccc1-c1cccc(C(=O)CCCC(=O)O)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 6/20 0.53
HDAC3 O15379 2/20 0.51
HDAC4 P56524 2/20 0.51
HDAC1 Q13547 2/20 0.51
HDAC7 Q8WUI4 2/20 0.51
HDAC2 Q92769 2/20 0.51
HDAC10 Q969S8 2/20 0.51
HDAC11 Q96DB2 2/20 0.51
HDAC8 Q9BY41 2/20 0.51
HDAC6 Q9UBN7 2/20 0.51
HDAC9 Q9UKV0 2/20 0.51
HDAC5 Q9UQL6 2/20 0.51
NR1H4 Q96RI1 2/20 0.51
FFAR4 Q5NUL3 3/20 0.49
GRIN2B Q13224 1/20 0.48
SMYD2 Q9NRG4 1/20 0.47
PTGER4 P35408 2/20 0.45
L3MBTL1 Q9Y468 2/20 0.44
LMNA P02545 2/20 0.44
MAPT P10636 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
SCHEMBL7108991 0.83 HDAC1 (0.50) FFAR1HDAC3HDAC4HDAC1HDAC7
SCHEMBL14241162 0.81 NR1H4 (0.53) FFAR1NR1H4FFAR4GRIN2BSMYD2
SCHEMBL2995452 0.79 NR1H4 (0.74) FFAR1NR1H4SMYD2MCL1PTGER1
SCHEMBL7112337 0.78 FFAR1 (0.61) FFAR1HDAC3HDAC4HDAC1HDAC7
SCHEMBL2743419 0.77 HDAC3 (0.58) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL27959627 0.77 NR1H4 (0.59) FFAR1NR1H4GRIN2BSMYD2MCL1
SCHEMBL28452076 0.77 NR1H4 (0.59) FFAR1NR1H4GRIN2BSMYD2L3MBTL1
SCHEMBL10788414 0.76 HDAC3 (0.45) FFAR1HDAC3HDAC4HDAC1HDAC7
SCHEMBL24307632 0.75 FFAR1 (0.73) FFAR1FFAR4PTGER4PTGER1PTGER3
SCHEMBL8532994 0.75 SMN1; SMN2 (0.67) FFAR1HDAC3HDAC4HDAC1HDAC7

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-1047665-B1 MATRIX METALLOPROTEASE INHIBITORS PFIZER LTD (GB) 2003-10-22 EP disclosed
US-6350907-B1 PEPTIDE ENZYME INHIBITORS PFIZER INC 2002-02-26 US disclosed
EP-1047665-A1 MATRIX METALLOPROTEASE INHIBITORS Pfizer Limited (GB) 2000-11-02 EP disclosed
WO-1999035124-A1 MATRIX METALLOPROTEASE INHIBITORS PFIZER LIMITED (GB) 1999-07-15 WO disclosed