SCHEMBL14949145

SCHEMBL14949145

CNC(=O)COc1ccc(OCC(=O)OC)cc1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 2/20 0.55
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
PKM P14618 1/20 0.52
RECQL P46063 1/20 0.52
ALDH1A1 P00352 2/20 0.51
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51
MAPT P10636 3/20 0.50
POLB P06746 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
MAPK1 P28482 1/20 0.47
HPGD P15428 1/20 0.47
KDM4E B2RXH2 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47

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
SCHEMBL2116437 0.88 PTGS2 (0.66) PTGS2MEN1KMT2AALDH1A1CYP2C9
SCHEMBL6539438 0.84 KMT2A (0.51) MEN1KMT2APKMRECQLALDH1A1
SCHEMBL4427417 0.83 PKM (0.54) MEN1KMT2APKMRECQLALDH1A1
SCHEMBL171840 0.83 MEN1 (0.61) MEN1KMT2APKMRECQLALDH1A1
SCHEMBL17775464 0.83 ALOX15 (0.59) MEN1KMT2APKMRECQLALDH1A1
SCHEMBL13916156 0.83 KMT2A (0.54) MEN1KMT2APKMRECQLALDH1A1
SCHEMBL10119179 0.83 PTGS2 (0.57) PTGS2MEN1KMT2AALDH1A1CYP2C9
SCHEMBL12061812 0.82 GAA (0.66) PTGS2MEN1KMT2AALDH1A1CYP2C9
SCHEMBL17365269 0.82 PTGS2 (0.60) PTGS2MEN1KMT2AALDH1A1CYP2C9
SCHEMBL778673 0.81 MEN1 (0.52) MEN1KMT2APKMRECQLALDH1A1

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-8637658-B2 Non-fluorescent quencher compounds and biomolecular assays APPLIED BIOSYSTEMS, LLC (US) 2014-01-28 US disclosed
US-20130123475-A1 Non-Fluorescent Quencher Compounds and Biomolecular Assays Life Technologies Corporation (US) 2013-05-16 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 (1 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-20130123475-A1 Non-Fluorescent Quencher Compounds and Biomolecular Assays DNTT, PNP, NT5C2 PTGS2 4417/4885MEN1 3897/4885KMT2A 3954/4885

“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.