SCHEMBL6743567

SCHEMBL6743567

C=C(CCCCC(C#N)CCOc1ccccc1-c1ccccc1)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 13/20 0.46
ALDH1A1 P00352 9/20 0.46
SMN1; SMN2 Q16637 3/20 0.44
KMT2A Q03164 3/20 0.44
GAA P10253 2/20 0.44
HTT P42858 3/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
MEN1 O00255 2/20 0.43
PKM P14618 1/20 0.43
LMNA P02545 2/20 0.43
POLB P06746 1/20 0.43
USP2 O75604 1/20 0.43

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
SCHEMBL6744564 0.85 KDM4E (0.48) KDM4EALDH1A1SMN1; SMN2KMT2AGAA
SCHEMBL19458668 0.84 KDM4E (0.60) KDM4EALDH1A1SMN1; SMN2KMT2AGAA
SCHEMBL5406839 0.83 HTT (0.46) KDM4EALDH1A1SMN1; SMN2KMT2AGAA
SCHEMBL9953483 0.83 KDM4E (0.59) KDM4EALDH1A1SMN1; SMN2KMT2AGAA
SCHEMBL19458858 0.83 KDM4E (0.59) KDM4EALDH1A1SMN1; SMN2KMT2AGAA
SCHEMBL450012 0.83 LMNA (0.58) KDM4EALDH1A1SMN1; SMN2KMT2AGAA
SCHEMBL8939333 0.81 KDM4E (0.48) KDM4EALDH1A1SMN1; SMN2KMT2AGAA
SCHEMBL156467 0.79 KDM4E (0.58) KDM4EALDH1A1SMN1; SMN2KMT2AGAA
SCHEMBL865586 0.72 ADRB2 (0.51) KDM4EALDH1A1SMN1; SMN2KMT2AHTT
Methacrylic Acid SCHEMBL8672885 0.72 KDM4E (0.55) KDM4EALDH1A1SMN1; SMN2KMT2AGAA

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-6696114-B1 POLARIZED ULTRAVIOLET RADIATED HYDROCARBON, (METH)ACRYLATE, OR SILOXANE POLYMER HAYASHI TELEMPU CO., LTD. (JP) 2004-02-24 US disclosed