SCHEMBL8664759

SCHEMBL8664759

CCc1ccc(C2=C(NC(=O)C(C)C)C(=O)c3ccccc32)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 13/20 0.49
HSP90AB1 P08238 13/20 0.49
EGFR P00533 1/20 0.45
TDP2 O95551 1/20 0.43
PAX8 Q06710 1/20 0.43
HKDC1 Q2TB90 1/20 0.43
TLR9 Q9NR96 1/20 0.43
FGFR1 P11362 1/20 0.43
SRC P12931 1/20 0.43
FGFR2 P21802 1/20 0.43
FGFR4 P22455 1/20 0.43
FGFR3 P22607 1/20 0.43
MAPT P10636 3/20 0.42
NPC1 O15118 1/20 0.42
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
MAPK1 P28482 1/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42

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
SCHEMBL8667027 0.88 HSP90AA1 (0.65) HSP90AA1HSP90AB1EGFRTDP2PAX8
SCHEMBL8665999 0.86 MAPT (0.52) HSP90AA1HSP90AB1EGFRTDP2PAX8
SCHEMBL8102262 0.86 HSP90AA1 (0.65) HSP90AA1HSP90AB1FGFR1SRCFGFR2
SCHEMBL8092553 0.85 TDP2 (0.61) HSP90AA1HSP90AB1EGFRTDP2PAX8
SCHEMBL8665166 0.84 HSP90AA1 (0.48) HSP90AA1HSP90AB1TDP2PAX8HKDC1
SCHEMBL8102104 0.83 TDP2 (0.52) HSP90AA1HSP90AB1EGFRTDP2PAX8
SCHEMBL8106236 0.79 FGFR1 (0.50) HSP90AA1HSP90AB1TDP2PAX8HKDC1
SCHEMBL8100343 0.74 HSP90AA1 (0.61) HSP90AA1HSP90AB1TDP2PAX8HKDC1
SCHEMBL8102495 0.73 TDP2 (0.46) HSP90AA1HSP90AB1TDP2PAX8HKDC1
SCHEMBL8102319 0.73 TDP2 (0.68) HSP90AA1HSP90AB1TDP2PAX8HKDC1

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-0882706-A1 Cell adhesion inhibitors ELI LILLY AND COMPANY (US) 1998-12-09 EP disclosed