SCHEMBL3814977

SCHEMBL3814977

CCCCCCCCC(/C=C/c1ccccc1)OC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
EGFR P00533 1/20 0.41
TDP1 Q9NUW8 2/20 0.38
TP53 P04637 1/20 0.37
MAPT P10636 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
CSNK1E P49674 1/20 0.37
ALDH1A1 P00352 1/20 0.37
RELA Q04206 1/20 0.37
TRPA1 O75762 1/20 0.36
LMNA P02545 2/20 0.36
TSHR P16473 1/20 0.36
HDAC3 O15379 2/20 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

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
SCHEMBL3482237 0.86 MEN1 (0.46) MEN1KMT2AEGFRTDP1TP53
SCHEMBL3481548 0.84 MEN1 (0.47) MEN1KMT2AEGFRTDP1TP53
SCHEMBL5165060 0.82 MEN1 (0.44) MEN1KMT2AEGFRTDP1ALDH1A1
SCHEMBL5165052 0.82 MEN1 (0.44) MEN1KMT2AEGFRTDP1ALDH1A1
SCHEMBL30953546 0.80 MEN1 (0.63) MEN1KMT2ARELATRPA1TUBB4A
SCHEMBL1171600 0.80 EGFR (0.44) MEN1KMT2AEGFRTDP1ALDH1A1
SCHEMBL1171601 0.80 EGFR (0.44) MEN1KMT2AEGFRTDP1ALDH1A1
SCHEMBL3481567 0.79 MEN1 (0.48) MEN1KMT2AEGFRTDP1RELA
SCHEMBL4264101 0.79 EGFR (0.44) MEN1KMT2AEGFRTDP1TP53
SCHEMBL2787091 0.79 EGFR (0.44) MEN1KMT2AEGFRTDP1TP53

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-1280508-B1 SKIN CARE COMPOSITION JOHNSON & JOHNSON CONSUMER (US) 2009-08-12 EP disclosed