SCHEMBL26219

SCHEMBL26219

CCCC[PH](CCCC)(CCCC)CCCOC(=O)c1ccc(C(C)COC(=O)OCC2c3ccccc3-c3ccccc32)c([N+](=O)[O-])c1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.38
ALDH1A1 P00352 5/20 0.34
RAB9A P51151 3/20 0.34
KMT2A Q03164 2/20 0.34
LMNA P02545 1/20 0.34
GLA P06280 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
TLR2 O60603 6/20 0.34
MAPT P10636 4/20 0.33
NPC1 O15118 1/20 0.33
PKM P14618 1/20 0.33
CRHBP P24387 1/20 0.33
CRHR2 Q13324 1/20 0.33
KDM4E B2RXH2 1/20 0.33
POLB P06746 1/20 0.33
PTGER4 P35408 1/20 0.32

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
SCHEMBL16016767 0.94 ESR1 (0.42) ESR1ALDH1A1RAB9AKMT2ALMNA
SCHEMBL26121 0.85 ESR1 (0.35) ESR1ALDH1A1MAPT
SCHEMBL26858 0.83 HCAR3 (0.41) ALDH1A1MAPT
SCHEMBL26859 0.82 MAPT (0.35) ALDH1A1KMT2ALMNANPSR1MAPT
SCHEMBL25432 0.80 ESR1 (0.49) ESR1ALDH1A1RAB9AKMT2ALMNA
SCHEMBL16016753 0.72 ESR1 (0.55) ESR1ALDH1A1RAB9AKMT2ALMNA
SCHEMBL31260595 0.71 MAPT (0.35) ALDH1A1KMT2ALMNANPSR1MAPT
SCHEMBL20717 0.71 HCAR3 (0.40) ALDH1A1MAPT
SCHEMBL16016718 0.70 THRA (0.41) ESR1ALDH1A1RAB9AKMT2ALMNA
SCHEMBL26165 0.69 LMNA (0.49) ALDH1A1RAB9AKMT2ALMNAL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9920084-B2 Ionic tags for synthesis of oligoribonucleotides THE ROYAL INSTITUTION FOR THE ADVANCEMENT OF LEARNING/MCGILL UNIVERSITY (CA) 2018-03-20 US disclosed
US-20140256926-A1 Ionic Tags for Synthesis of Oligoribonucleotides HONG KONG POLYTECHNIC UNIVERSITY (HK) 2014-09-11 US disclosed
US-20140256926-A1 Ionic Tags for Synthesis of Oligoribonucleotides HONG KONG POLYTECHNIC UNIVERSITY (HK) 2014-09-11 US disclosed
WO-2013026142-A1 IONIC TAGS FOR SYNTHESIS OF OLIGORIBONUCLEOTIDES THE ROYAL INSTITUTION FOR THE ADVANCEMENT OF LEARNING/MCGILL UNIVERSITY (CA) 2013-02-28 WO disclosed
WO-2012024776-A1 BLOCK SYNTHESIS OF OLIGORIBONUCLEOTIDES THE ROYAL INSTITUTION FOR THE ADVANCEMENT OF LEARNING/MCGILL UNIVERSITY (CA) 2012-03-01 WO 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-20140256926-A1 Ionic Tags for Synthesis of Oligoribonucleotides RNGTT, OSTC, OSGEP ESR1 4213/4885ALDH1A1 3379/4885RAB9A 4792/4885

“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.