SCHEMBL4906918

SCHEMBL4906918

O=C(OCc1ccccc1)C(=O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.52
FABP5 Q01469 3/20 0.51
FABP7 O15540 2/20 0.51
EPHX2 P34913 1/20 0.49
ALDH1A1 P00352 4/20 0.46
MAPK1 P28482 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
SLC6A2 P23975 1/20 0.45
SLC6A3 Q01959 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
HDAC1 Q13547 1/20 0.43
HDAC2 Q92769 1/20 0.43
MAPT P10636 1/20 0.42
LMNA P02545 1/20 0.41

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
SCHEMBL15981181 0.88 KMT2A (0.58) KMT2AFABP5FABP7EPHX2CA1
SCHEMBL10937196 0.86 FABP5 (0.46) KMT2AFABP5FABP7EPHX2ALDH1A1
SCHEMBL648282 0.84 KMT2A (0.49) KMT2AFABP5FABP7EPHX2ALDH1A1
SCHEMBL10405601 0.83 FABP5 (0.56) KMT2AFABP5FABP7EPHX2CA1
SCHEMBL30253705 0.83 FABP5 (0.52) KMT2AFABP5FABP7EPHX2CA1
SCHEMBL13140300 0.81 EPHX2 (0.47) KMT2AFABP5FABP7EPHX2ALDH1A1
SCHEMBL44677 0.80 FABP5 (0.59) KMT2AFABP5FABP7EPHX2CA1
SCHEMBL29381061 0.80 FABP5 (0.59) KMT2AFABP5FABP7EPHX2CA1
SCHEMBL29901230 0.80 FABP5 (0.59) KMT2AFABP5FABP7EPHX2CA1
SCHEMBL15982314 0.80 KMT2A (0.48) KMT2AFABP5FABP7EPHX2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080161202-A1 Novel strategy for selective regulation of background surface property in microarray fabrication and method to eliminated self quenching in micro arrays INTEL CORPORATION 2008-07-03 US claimed
US-10273539-B2 Methods of using nucleotide analogues QIAGEN SCIENCES, LLC (US) 2019-04-30 US disclosed
US-9725474-B2 Modified nucleic acid TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2017-08-08 US disclosed
US-20160016983-A1 New Modified Nucleic Acid TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2016-01-21 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20160016983-A1 New Modified Nucleic Acid RNGTT, RNASEH1, RNASE1 KMT2A 839/4885FABP5 802/4885FABP7 925/4885
US-10273539-B2 Methods of using nucleotide analogues NT5C3B, SAMHD1, RNGTT KMT2A 2787/4885FABP5 4646/4885FABP7 4528/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.