SCHEMBL3679147

SCHEMBL3679147

CCc1cc(N2C(=O)C=C(C)C2=O)c(C)cc1N1C(=O)C=C(C)C1=O

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 1/20 0.33
TSHR P16473 2/20 0.31
LMNA P02545 1/20 0.31
HPGD P15428 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
L3MBTL1 Q9Y468 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
SCHEMBL3684376 0.88 HPGD (0.34) MGLLHPGD
SCHEMBL3681485 0.78 MGLL (0.38) MGLLTSHRLMNAHPGDSMN1; SMN2
SCHEMBL20261770 0.76 MGLL (0.59) MGLLTSHRLMNA
SCHEMBL2229875 0.76 MGLL (0.43) MGLLHPGD
SCHEMBL3680070 0.75 MGLL (0.33) MGLL
SCHEMBL3684380 0.74 CCR6 (0.31) MGLL
SCHEMBL23791651 0.72 ESR1 (0.38) MGLLTSHRHPGDL3MBTL1
SCHEMBL1116215 0.71 KMT2A (0.41) MGLLTSHRLMNAHPGDSMN1; SMN2
SCHEMBL3686454 0.71 KMT2A (0.41) MGLLTSHRLMNAHPGD
SCHEMBL3677441 0.71 MGLL (0.41) MGLLTSHRLMNAHPGDSMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100175805-A1 RUBBER COMPOSITION FOR COVERING TEXTILE CORD AND TIRE EMPLOYING THE SAME SUMITOMO RUBBER INDUSTRIES, LTD. (JP) 2010-07-15 US disclosed