SCHEMBL2569485

SCHEMBL2569485

CN(C)C(=O)c1cc(OCc2ccccc2)cc(-c2ccc(CNC(=O)O)cc2)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.48
▸ ADAMTS5 Q9UNA0 1/20 0.47
▸ KMT2A Q03164 4/20 0.46
▸ MEN1 O00255 3/20 0.46
▸ SMPD1 P17405 1/20 0.46
▸ BRD4 O60885 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ ALDH1A1 P00352 2/20 0.43
▸ CYP1A2 P05177 2/20 0.43
▸ CYP2D6 P10635 2/20 0.43
▸ HSD17B10 Q99714 2/20 0.43
▸ CLK4 Q9HAZ1 2/20 0.43
▸ HDAC1 Q13547 1/20 0.43
▸ USP2 O75604 1/20 0.43
▸ CYP3A4 P08684 1/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ CYP2C19 P33261 1/20 0.43
▸ EGFR P00533 1/20 0.43
▸ MAOB P27338 1/20 0.43

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
SCHEMBL2567487 0.88 HDAC1 (0.50) LMNAADAMTS5KMT2AMEN1SMPD1
Hydrochloric Acid SCHEMBL2573542 0.84 MAOB (0.50) KMT2AMEN1SMPD1BRD4EGFR
SCHEMBL2574407 0.79 MRGPRX4 (0.60) LMNAADAMTS5SMPD1
SCHEMBL2570746 0.77 KMT2A (0.59) KMT2AMEN1SMPD1BRD4CYP1A2
SCHEMBL2570653 0.76 BRD4 (0.50) BRD4EGFRNPC1RAB9A
SCHEMBL26633561 0.75 BCHE (0.67) LMNAADAMTS5KMT2AMEN1SMN1; SMN2
SCHEMBL731203 0.74 LMNA (0.62) LMNAKMT2AMEN1SMPD1SMN1; SMN2
SCHEMBL31464882 0.73 MEN1 (0.68) KMT2AMEN1SMPD1SMN1; SMN2L3MBTL1
SCHEMBL8200793 0.71 MAOB (0.69) BRD4SMN1; SMN2L3MBTL1ALDH1A1EGFR
SCHEMBL25247564 0.70 BCHE (0.67) KMT2AMEN1SMPD1L3MBTL1ALDH1A1

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 LMNA 677/4885ADAMTS5 2719/4885KMT2A 2172/4885
US-20070179115-A1 Purinenucleoside derivative modified in 8-position and medical use thereof NUDT1, SLC28A2, PNP LMNA 591/4885ADAMTS5 2973/4885KMT2A 1816/4885

“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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