SCHEMBL4585433

SCHEMBL4585433

C=C(C(=O)O)C(C)Oc1ccccc1Cl

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.54
HPGD P15428 3/20 0.54
MEN1 O00255 2/20 0.54
ALDH1A1 P00352 5/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
MAPT P10636 2/20 0.47
LMNA P02545 2/20 0.44
L3MBTL1 Q9Y468 1/20 0.43
POLB P06746 1/20 0.43
XBP1 P17861 1/20 0.42
ATM Q13315 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
XIAP P98170 1/20 0.42
GHSR Q92847 1/20 0.41
GAA P10253 1/20 0.41
TP53 P04637 1/20 0.40
HTR1D P28221 2/20 0.40
SLC6A9 P48067 1/20 0.40
CXCL8 P10145 1/20 0.40

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
SCHEMBL503699 0.83 KMT2A (0.66) KMT2AHPGDMEN1ALDH1A1SMN1; SMN2
SCHEMBL8935734 0.83 KMT2A (0.66) KMT2AHPGDMEN1ALDH1A1SMN1; SMN2
SCHEMBL3955181 0.82 HPGD (0.50) KMT2AHPGDMEN1ALDH1A1SMN1; SMN2
SCHEMBL22500529 0.81 LMNA (0.48) KMT2AMEN1ALDH1A1SMN1; SMN2MAPT
SCHEMBL5825558 0.80 KMT2A (0.59) KMT2AHPGDMEN1ALDH1A1SMN1; SMN2
SCHEMBL156468 0.79 KDM4E (0.46) KMT2AMEN1ALDH1A1SMN1; SMN2MAPT
SCHEMBL44089 0.79 GAA (0.55) KMT2AHPGDMEN1SMN1; SMN2MAPT
SCHEMBL1829907 0.78 PPARG (0.51) KMT2AHPGDMEN1ALDH1A1L3MBTL1
SCHEMBL16244235 0.78 KMT2A (0.57) KMT2AHPGDMEN1ALDH1A1SMN1; SMN2
SCHEMBL28729952 0.77 KMT2A (0.56) KMT2AHPGDMEN1ALDH1A1SMN1; SMN2

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-20080248402-A1 PHOTOSENSITIVE COMPOSITION FOR VOLUME HOLOGRAM RECORDING AND PHOTOSENSITIVE MEDIUM FOR VOLUME HOLOGRAM RECORDING DAI NIPPON PRINTING CO., LTD. (JP) 2008-10-09 US disclosed