SCHEMBL22354569

SCHEMBL22354569

OCCN(CCO)CC(O)CN(CC(O)CN(CCO)CCO)c1ccccc1

nearest known ligand 0.73

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.73
L3MBTL1 Q9Y468 1/20 0.53
TSHR P16473 2/20 0.49
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
ALDH1A1 P00352 4/20 0.43
MAPT P10636 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
GAA P10253 2/20 0.42
MAPK1 P28482 1/20 0.42
P2RX3 P56373 1/20 0.39
LMNA P02545 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
FPR2 P25090 1/20 0.36
POLB P06746 1/20 0.35
APOBEC3A P31941 1/20 0.35
APOBEC3G Q9HC16 1/20 0.35

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
SCHEMBL9371410 0.87 KDM4E (0.59) KDM4EL3MBTL1TSHRMEN1KMT2A
SCHEMBL12403375 0.83 KDM4E (0.51) KDM4EL3MBTL1TSHRMEN1KMT2A
SCHEMBL8959067 0.79 KDM4E (0.44) KDM4EL3MBTL1TSHRMEN1KMT2A
SCHEMBL10771235 0.77 KDM4E (0.49) KDM4EL3MBTL1TSHRMEN1KMT2A
SCHEMBL8617028 0.76 KDM4E (0.55) KDM4EL3MBTL1TSHRMEN1KMT2A
SCHEMBL3714435 0.75 MEN1 (0.48) KDM4EL3MBTL1TSHRMEN1KMT2A
SCHEMBL78451 0.74 KDM4E (0.46) KDM4EL3MBTL1TSHRMEN1KMT2A
SCHEMBL15459021 0.74 TSHR (0.50) KDM4ETSHRMEN1KMT2AALDH1A1
SCHEMBL9015952 0.73 KDM4E (0.48) KDM4EL3MBTL1TSHRALDH1A1MAPT
SCHEMBL3536621 0.73 TSHR (0.44) KDM4EL3MBTL1TSHRALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230159581-A1 NOVEL ANTI-INFECTIVE AND ANTI-INFLAMMATORY COMPOUNDS SYNOVO GMBH (DE) 2023-05-25 US disclosed
US-20230159581-A1 NOVEL ANTI-INFECTIVE AND ANTI-INFLAMMATORY COMPOUNDS SYNOVO GMBH (DE) 2023-05-25 US disclosed
US-20230131943-A1 ANTI-INFECTIVE AND ANTI-VIRAL COMPOUNDS AND COMPOSITIONS BURNET MICHEAL W (DE) 2023-04-27 US disclosed
US-20230131943-A1 ANTI-INFECTIVE AND ANTI-VIRAL COMPOUNDS AND COMPOSITIONS BURNET MICHEAL W (DE) 2023-04-27 US disclosed
WO-2021195126-A1 ANTI-INFECTIVE AND ANTI-VIRAL COMPOUNDS AND COMPOSITIONS BURNET MICHAEL W (DE) 2021-09-30 WO disclosed
US-20200262857-A1 NOVEL ANTI-INFECTIVE AND ANTI-INFLAMMATORY COMPOUNDS SYNOVO GMBH (DE) 2020-08-20 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 (3 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-20230131943-A1 ANTI-INFECTIVE AND ANTI-VIRAL COMPOUNDS AND COMPOSITIONS CTSA, GAA, SLC7A5 KDM4E 3394/4885L3MBTL1 1536/4885TSHR 4510/4885
US-20230159581-A1 NOVEL ANTI-INFECTIVE AND ANTI-INFLAMMATORY COMPOUNDS CTSA, ALOX15, ALOX5 KDM4E 3648/4885L3MBTL1 1562/4885TSHR 4450/4885
US-20200262857-A1 NOVEL ANTI-INFECTIVE AND ANTI-INFLAMMATORY COMPOUNDS CTSA, ALOX15, ALOX5 KDM4E 3648/4885L3MBTL1 1562/4885TSHR 4450/4885

“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.