SCHEMBL2570746

SCHEMBL2570746

CN(C)C(=O)c1cc(O)cc(OCc2ccccc2)c1

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.59
▸ MEN1 O00255 1/20 0.59
▸ MAOB P27338 3/20 0.54
▸ NR4A2 P43354 2/20 0.52
▸ BRD4 O60885 1/20 0.52
▸ EGFR P00533 3/20 0.49
▸ ALOX5 P09917 1/20 0.49
▸ CYP1A1 P04798 1/20 0.49
▸ CYP1A2 P05177 1/20 0.49
▸ CYP19A1 P11511 1/20 0.49
▸ NR4A1 P22736 1/20 0.49
▸ NR4A3 Q92570 1/20 0.49
▸ SMPD1 P17405 1/20 0.48
▸ SRD5A2 P31213 1/20 0.47
▸ PARP10 Q53GL7 1/20 0.47
▸ LTB4R Q15722 1/20 0.46
▸ LTB4R2 Q9NPC1 1/20 0.46

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
SCHEMBL6943448 0.84 MAOB (0.70) KMT2AMEN1MAOBNR4A2CYP1A1
SCHEMBL2570286 0.83 MEN1 (0.84) KMT2AMEN1MAOBNR4A2CYP1A1
SCHEMBL8200793 0.82 MAOB (0.69) MAOBNR4A2BRD4EGFRALOX5
SCHEMBL29475634 0.81 LMNA (0.69) KMT2AMEN1MAOBNR4A2CYP1A1
SCHEMBL90412 0.81 LMNA (0.69) KMT2AMEN1MAOBNR4A2CYP1A1
SCHEMBL14255438 0.81 SRD5A2 (0.65) KMT2AMEN1MAOBNR4A2CYP1A1
Hydrochloric Acid SCHEMBL2573542 0.79 MAOB (0.50) KMT2AMEN1MAOBNR4A2BRD4
SCHEMBL19809534 0.79 CA12 (0.59) KMT2AMEN1MAOBNR4A2CYP1A1
SCHEMBL2007390 0.78 CYP1A2 (0.67) KMT2AMEN1MAOBNR4A2ALOX5
SCHEMBL1834526 0.78 CYP1A2 (0.67) KMT2AMEN1MAOBNR4A2ALOX5

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
EP-1813623-B1 PURINENUCLEOSIDE DERIVATIVE MODIFIED IN 8-POSITION AND MEDICINAL USE THEREOF KISSEI PHARMACEUTICAL (JP) 2011-11-09 — — EP disclosed
US-20100249054-A9 PURINE NUCLEOSIDE DERIVATIVE MODIFIED IN 8-POSITION AND MEDICAL USE THEREOF KISSEI PHARMACEUTICAL CO., LTD. (JP) 2010-09-30 — — US disclosed
US-7795236-B2 Purine nucleoside derivative modified in 8-position and medical use thereof KISSEI PHARMACEUTICAL CO., LTD. (JP) 2010-09-14 — — US disclosed
US-20070179115-A1 Purinenucleoside derivative modified in 8-position and medical use thereof KISSEI PHARMACEUTICAL CO., LTD. (JP) 2007-08-02 — — US disclosed
EP-1813623-A1 PURINENUCLEOSIDE DERIVATIVE MODIFIED IN 8-POSITION AND MEDICINAL USE THEREOF Kissei Pharmaceutical Co., Ltd. (JP) 2007-08-01 — — EP 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-20100249054-A9 PURINE NUCLEOSIDE DERIVATIVE MODIFIED IN 8-POSITION AND MEDICAL USE THEREOF NUDT1, PNP, SLC28A2 KMT2A 2172/4885MEN1 3310/4885MAOB 2260/4885
US-20070179115-A1 Purinenucleoside derivative modified in 8-position and medical use thereof NUDT1, SLC28A2, PNP KMT2A 1816/4885MEN1 3540/4885MAOB 2664/4885

“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.

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