SCHEMBL8627211

SCHEMBL8627211

C=CC(OC(=O)C(=C)C)Oc1ccc(C(=O)O)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.49
HTT P42858 2/20 0.47
POLB P06746 1/20 0.47
APEX1 P27695 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
ELANE P08246 1/20 0.42
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
HSD17B10 Q99714 2/20 0.40
SRD5A2 P31213 2/20 0.39
ALDH1A1 P00352 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
MAPT P10636 1/20 0.37
MAPK1 P28482 2/20 0.37
PLA2G4B P0C869 1/20 0.37
TSHR P16473 2/20 0.35
USP2 O75604 1/20 0.35
ALOX15 P16050 1/20 0.35
HPGD P15428 1/20 0.35
PARP15 Q460N3 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
SCHEMBL299826 0.87 ELANE (0.42) KMT2AELANEALDH1A1TSHRHPGD
SCHEMBL8634740 0.81 KMT2A (0.49) KMT2AHTTCA1CA2HSD17B10
SCHEMBL8674500 0.81 KMT2A (0.57) KMT2AHTTPOLBAPEX1TDP1
SCHEMBL2638606 0.77 HTT (0.50) KMT2AHTTPOLBAPEX1TDP1
SCHEMBL9283142 0.75 PTGS2 (0.49) KMT2AHTTMAPT
SCHEMBL9193031 0.73 KMT2A (0.65) KMT2AHTTCA1CA2HSD17B10
SCHEMBL346685 0.73 ELANE (0.72) KMT2AHTTPOLBAPEX1TDP1
SCHEMBL1419286 0.72 MTNR1A (0.41) KMT2APOLBTDP1ELANEALDH1A1
SCHEMBL28678913 0.72 POLB (0.48) KMT2AHTTPOLBAPEX1TDP1
SCHEMBL3657017 0.72 KMT2A (0.56) KMT2AHTTTDP1CA1CA2

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-5707543-A LIGHT SCATTERING AND RADIATION TRANSPARENT MEDIUM ON SUBSTRATES FOR OPTICAL RECORDING MEDIA USING LIQUID CRYSTALS FUJI XEROX CO., LTD. (JP) 1998-01-13 US claimed