SCHEMBL6819960

SCHEMBL6819960

CCCC(C(=O)CCCCc1ccccc1)C(=O)OC

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.46
RXFP1 Q9HBX9 1/20 0.46
ALOX5 P09917 2/20 0.46
HDAC1 Q13547 1/20 0.46
HDAC2 Q92769 1/20 0.46
CES1 P23141 3/20 0.44
FAAH O00519 2/20 0.44
CTSK P43235 2/20 0.44
SIGMAR1 Q99720 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
LMNA P02545 1/20 0.43
PKM P14618 1/20 0.43

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
SCHEMBL7059341 0.89 HPGD (0.48) CTSKSMN1; SMN2
SCHEMBL7055651 0.88 EPHX2 (0.48) CTSK
SCHEMBL7055434 0.85 PRSS1 (0.48) MAPTCTSKSMN1; SMN2LMNA
SCHEMBL11206513 0.79 CYP2D6 (0.49) HDAC1HDAC2SMN1; SMN2LMNAPKM
SCHEMBL16672819 0.79 BIRC2 (0.48) FAAHCTSKSIGMAR1
SCHEMBL7061349 0.79 SMN1; SMN2 (0.49) MAPTSMN1; SMN2
SCHEMBL1857901 0.77 GRIK1 (0.49) ALOX5CTSKSMN1; SMN2
SCHEMBL7633465 0.77 FAAH (0.47) MAPTRXFP1FAAHLMNA
SCHEMBL7060674 0.77 TDP1 (0.49) MAPTALOX5HDAC1HDAC2CTSK
SCHEMBL10889375 0.76 ALDH1A1 (0.52) ALOX5HDAC1HDAC2SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0871439-B1 SUBSTITUTED (ARYL, HETEROARYL, ARYLMETHYL OR HETEROARYLMETHYL) HYDROXAMIC ACID COMPOUNDS AVENTIS PHARMA INC (US) 2004-03-31 EP disclosed
US-6057369-A USE IN THE TREATMENT OF DISEASE STATES ASSOCIATED WITH PROTEINS THAT MEDIATE CELLULAR ACTIVITY WHICH ARE CAPABLE OF BEING MODULATED BY INHIBITING A MATRIX METALLOPROTEINASE (MMP), TUMOR NECROSIS FACTOR (TNF) OR CYCLIC AMP RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 2000-05-02 US disclosed
EP-0871439-A4 SUBSTITUTED (ARYL, HETEROARYL, ARYLMETHYL OR HETEROARYLMETHYL) HYDROXAMIC ACID COMPOUNDS RHONE POULENC RORER PHARMA (US) 1999-07-21 EP disclosed
EP-0871439-A1 SUBSTITUTED (ARYL, HETEROARYL, ARYLMETHYL OR HETEROARYLMETHYL) HYDROXAMIC ACID COMPOUNDS RHONE-POULENC RORER PHARMACEUTICALS, INC. (US) 1998-10-21 EP disclosed
WO-1997024117-A1 SUBSTITUTED (ARYL, HETEROARYL, ARYLMETHYL OR HETEROARYLMETHYL) HYDROXAMIC ACID COMPOUNDS RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1997-07-10 WO disclosed