SCHEMBL14469103

SCHEMBL14469103

CCC(/C=C(\O)C(C)(C)C)/C=C/c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
CYP1A2 P05177 1/20 0.37
HDAC3 O15379 1/20 0.36
HDAC4 P56524 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC7 Q8WUI4 1/20 0.36
HDAC2 Q92769 1/20 0.36
HDAC10 Q969S8 1/20 0.36
HDAC11 Q96DB2 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
HDAC9 Q9UKV0 1/20 0.36
HDAC5 Q9UQL6 1/20 0.36
CYP2C19 P33261 1/20 0.36
NPC1 O15118 2/20 0.36
TSHR P16473 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
EGFR P00533 1/20 0.35
KDM4E B2RXH2 1/20 0.35

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
SCHEMBL1830592 0.74 MEN1 (0.46) MEN1KMT2ACYP1A2NPC1L3MBTL1
SCHEMBL11959996 0.70 MEN1 (0.49) MEN1KMT2ACYP1A2NPC1L3MBTL1
SCHEMBL866662 0.70 MEN1 (0.49) MEN1KMT2ACYP1A2NPC1L3MBTL1
SCHEMBL2522305 0.70 MEN1 (0.49) MEN1KMT2ACYP1A2NPC1L3MBTL1
SCHEMBL866661 0.70 MEN1 (0.49) MEN1KMT2ACYP1A2NPC1L3MBTL1
SCHEMBL11960056 0.70 MEN1 (0.49) MEN1KMT2ACYP1A2NPC1L3MBTL1
SCHEMBL9426848 0.69 MEN1 (0.51) MEN1KMT2ACYP1A2NPC1L3MBTL1
SCHEMBL4615601 0.68 MEN1 (0.47) MEN1KMT2ACYP1A2KDM4EALDH1A1
SCHEMBL4615602 0.68 MEN1 (0.47) MEN1KMT2ACYP1A2KDM4EALDH1A1
SCHEMBL16874337 0.67 MEN1 (0.50) MEN1KMT2ACYP1A2CYP2C19NPC1

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-20070172758-A1 Planographic printing plate material and its manufacturing process KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2007-07-26 US disclosed