SCHEMBL8926671

SCHEMBL8926671

O=C(O)c1ccccc1OCCCCCOc1ccccc1C(=O)O

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.76
KMT2A Q03164 4/20 0.76
PTK2B Q14289 1/20 0.76
KDM4E B2RXH2 6/20 0.62
HTT P42858 2/20 0.62
LMNA P02545 4/20 0.60
MAPT P10636 3/20 0.60
MEN1 O00255 3/20 0.60
NR1I2 O75469 1/20 0.60
CHRM2 P08172 1/20 0.60
CYP3A4 P08684 1/20 0.60
ADRA2A P08913 1/20 0.60
OPRK1 P41145 1/20 0.60
HTR2B P41595 1/20 0.60
SLC6A3 Q01959 1/20 0.60
HDAC6 Q9UBN7 1/20 0.60
SMN1; SMN2 Q16637 2/20 0.57
PTPN11 Q06124 1/20 0.56
NPC1 O15118 1/20 0.55
CYP2C9 P11712 1/20 0.55

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
SCHEMBL571511 1.00 ALDH1A1 (0.76) ALDH1A1KMT2APTK2BKDM4EHTT
SCHEMBL29400029 1.00 ALDH1A1 (0.76) ALDH1A1KMT2APTK2BKDM4EHTT
SCHEMBL212173 0.94 ALDH1A1 (0.79) ALDH1A1KMT2APTK2BKDM4EHTT
SCHEMBL25788072 0.93 ALDH1A1 (0.67) ALDH1A1KMT2APTK2BKDM4EHTT
SCHEMBL11044267 0.93 ALDH1A1 (0.67) ALDH1A1KMT2APTK2BKDM4EHTT
SCHEMBL8906750 0.93 ALDH1A1 (0.67) ALDH1A1KMT2APTK2BKDM4EHTT
SCHEMBL8722933 0.93 ALDH1A1 (0.67) ALDH1A1KMT2APTK2BKDM4EHTT
SCHEMBL3624724 0.93 ALDH1A1 (0.67) ALDH1A1KMT2APTK2BKDM4EHTT
SCHEMBL30211332 0.92 ALDH1A1 (0.89) ALDH1A1KMT2APTK2BKDM4EHTT
SCHEMBL2049483 0.92 ALDH1A1 (0.89) ALDH1A1KMT2APTK2BKDM4EHTT

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-5663042-A LIGHT AND HEAT SENSITIVE SILVER HALIDE ELEMENNTS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1997-09-02 US disclosed
EP-0681210-A1 Novel developing agents for (photo) thermographic systems MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1995-11-08 EP disclosed