SCHEMBL20873608

SCHEMBL20873608

CCCCCCCCCCCCCCCCCC(C=Cc1ccccc1)C=C(C)C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.45
HDAC3 O15379 7/20 0.42
TDP1 Q9NUW8 1/20 0.42
HDAC1 Q13547 5/20 0.41
HDAC2 Q92769 5/20 0.41
HDAC8 Q9BY41 5/20 0.41
HDAC6 Q9UBN7 4/20 0.41
HDAC4 P56524 2/20 0.41
HDAC7 Q8WUI4 2/20 0.41
HDAC10 Q969S8 2/20 0.41
HDAC11 Q96DB2 2/20 0.41
HDAC9 Q9UKV0 2/20 0.41
HDAC5 Q9UQL6 2/20 0.41
AKR1C3 P42330 1/20 0.41
LMNA P02545 1/20 0.40
TUBB4A P04350 2/20 0.39
TUBB P07437 2/20 0.39
TUBA3C P0DPH7 2/20 0.39
TUBA1B P68363 2/20 0.39
TUBA4A P68366 2/20 0.39

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
SCHEMBL11415941 0.81 EGFR (0.50) EGFRHDAC3TDP1HDAC1HDAC2
SCHEMBL1221307 0.80 EGFR (0.44) EGFRHDAC3TDP1HDAC1HDAC2
SCHEMBL29180935 0.80 EGFR (0.44) EGFRHDAC3TDP1HDAC1HDAC2
SCHEMBL2350390 0.80 LCK (0.50)
SCHEMBL1702508 0.80 LCK (0.50)
SCHEMBL1220655 0.79 LMNA (0.43) EGFRHDAC3TDP1HDAC1HDAC2
SCHEMBL579053 0.78 EGFR (0.49) EGFRHDAC3TDP1HDAC1HDAC2
SCHEMBL5858046 0.77 EGFR (0.51) EGFRHDAC3TDP1HDAC1HDAC2
SCHEMBL8722881 0.77 EGFR (0.51) EGFRHDAC3TDP1HDAC1HDAC2
SCHEMBL5858044 0.77 EGFR (0.51) EGFRHDAC3TDP1HDAC1HDAC2

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-3056534-B1 EXPANDABLE VINYL AROMATIC POLYMERIC COMPOSITIONS VERSALIS SPA (IT) 2019-04-10 EP claimed