SCHEMBL19285487

SCHEMBL19285487

N#C/C(=C\c1ccc(C=Cc2ccc(N(c3ccccc3)c3ccccc3)cc2)s1)C(=O)O

nearest known ligand 0.67

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.66
APP P05067 1/20 0.55
SLC16A3 O15427 2/20 0.49
SLC16A1 P53985 2/20 0.49
ALDH1A1 P00352 2/20 0.43
HPGD P15428 2/20 0.43
KMT2A Q03164 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
CISD1 Q9NZ45 1/20 0.43
KDM4E B2RXH2 1/20 0.43
CYP3A4 P08684 1/20 0.43
GPR35 Q9HC97 1/20 0.43
EGFR P00533 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
SCHEMBL10059200 1.00 MAPT (0.66) MAPTAPPSLC16A3SLC16A1ALDH1A1
SCHEMBL12327596 1.00 MAPT (0.66) MAPTAPPSLC16A3SLC16A1ALDH1A1
SCHEMBL12250032 1.00 MAPT (0.66) MAPTAPPSLC16A3SLC16A1ALDH1A1
SCHEMBL14335877 1.00 MAPT (0.66) MAPTAPPSLC16A3SLC16A1ALDH1A1
SCHEMBL12294125 0.94 MAPT (0.76) MAPTAPPSLC16A3SLC16A1ALDH1A1
SCHEMBL14962658 0.90 MAPT (0.55) MAPTAPPSLC16A3SLC16A1ALDH1A1
SCHEMBL16982568 0.88 MAPT (0.52) MAPTAPPSLC16A3SLC16A1ALDH1A1
SCHEMBL14769759 0.88 MAPT (0.52) MAPTAPPSLC16A3SLC16A1ALDH1A1
SCHEMBL14518203 0.87 MAPT (0.52) MAPTAPPSLC16A3SLC16A1ALDH1A1
SCHEMBL14948624 0.87 MAPT (0.74) MAPTAPPSLC16A3SLC16A1ALDH1A1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190049473-A1 METHODS AND COMPOSITIONS FOR USING SOLVATOCHROMIC DYES TO DETECT THE PRESENCE OF HOMEOPATHIC POTENCIES STANDARD HOMEOPATHIC COMPANY (US) 2019-02-14 US disclosed
WO-2017147616-A1 METHODS AND COMPOSITIONS FOR USING SOLVATOCHROMIC DYES TO DETECT THE PRESENCE OF HOMEOPATHIC POTENCIES STANDARD HOMEOPATHIC COMPANY (US) 2017-08-31 WO disclosed