SCHEMBL15419403

SCHEMBL15419403

CCCC[C]=Cc1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.40
TDP1 Q9NUW8 2/20 0.39
EGFR P00533 1/20 0.36
HDAC3 O15379 1/20 0.36
CNR1 P21554 1/20 0.36
MAOB P27338 1/20 0.36
PCSK9 Q8NBP7 1/20 0.34
LTA4H P09960 1/20 0.34
PTGS2 P35354 1/20 0.33
RELA Q04206 1/20 0.33
MAPT P10636 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
SIGMAR1 Q99720 1/20 0.32

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
SCHEMBL10492237 0.94 LMNA (0.42) LMNATDP1EGFRHDAC3CNR1
SCHEMBL8369796 0.94 LMNA (0.42) LMNATDP1EGFRHDAC3CNR1
SCHEMBL8369798 0.94 LMNA (0.42) LMNATDP1EGFRHDAC3CNR1
SCHEMBL8019898 0.92 TDP1 (0.44) LMNATDP1EGFRCNR1MAPT
SCHEMBL3499907 0.92 TDP1 (0.44) LMNATDP1EGFRCNR1MAPT
SCHEMBL8019896 0.92 TDP1 (0.44) LMNATDP1EGFRCNR1MAPT
SCHEMBL11424521 0.87 MAOB (0.39) LMNATDP1MAOBRELA
SCHEMBL4076697 0.87 MAOB (0.39) LMNATDP1MAOBRELA
SCHEMBL1509680 0.78 MAOB (0.42) LMNAMAOBRELA
SCHEMBL5083636 0.78 MAOB (0.42) LMNAMAOBRELA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2483326-B1 COMPOSITION COMPRISING MIXED ELASTOMERS AND SUPRAMOLECULAR POLYMERS ARKEMA FRANCE (FR) 2014-01-22 EP claimed