SCHEMBL3103448

SCHEMBL3103448

CN(CC(N)=O)c1cc(C(=O)O)nc(N2CCOCC2)n1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ NAPEPLD Q6IQ20 1/20 0.49
▸ MAPK1 P28482 1/20 0.48
▸ PIK3CA P42336 15/20 0.48
▸ LMNA P02545 1/20 0.46
▸ POLB P06746 1/20 0.46
▸ HTT P42858 1/20 0.46
▸ HSD17B10 Q99714 1/20 0.46
▸ GPR55 Q9Y2T6 1/20 0.46
▸ AOC3 Q16853 2/20 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
SCHEMBL3116657 0.87 NAPEPLD (0.48) NAPEPLDMAPK1PIK3CA
SCHEMBL3117364 0.85 PIK3CA (0.59) NAPEPLDPIK3CA
SCHEMBL3112882 0.84 NAPEPLD (0.47) NAPEPLDMAPK1PIK3CA
SCHEMBL3105942 0.84 MAPK1 (0.51) NAPEPLDMAPK1PIK3CALMNAPOLB
SCHEMBL3106073 0.82 PIK3CA (0.62) NAPEPLDPIK3CA
SCHEMBL3114617 0.81 PIK3CA (0.48) NAPEPLDMAPK1PIK3CALMNAPOLB
SCHEMBL3100688 0.80 PIK3CA (0.50) NAPEPLDMAPK1PIK3CALMNAPOLB
SCHEMBL27680969 0.79 NAPEPLD (0.54) NAPEPLDMAPK1PIK3CALMNAPOLB
SCHEMBL3105230 0.77 NAPEPLD (0.48) NAPEPLDMAPK1PIK3CA
SCHEMBL3103084 0.77 PIK3CA (0.52) NAPEPLDPIK3CALMNAPOLBHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100256132-A1 IL-12 MODULATORY COMPOUNDS SYNTA PHARMACEUTICALS CORPORATION (US) 2010-10-07 — — US claimed
EP-1819341-A2 IL-12 MODULATORY COMPOUNDS Synta Pharmaceuticals Corporation (US) 2007-08-22 — — EP claimed
US-20060223996-A1 IL-12 modulatory compounds SYNTA PHARMACEUTICALS CORP. (US) 2006-10-05 — — US claimed
WO-2006053227-A2 IL-12 MODULATORY COMPOUNDS SYNTA PHARMACEUTICALS CORP. (US) 2006-05-18 — — WO claimed
US-8236795-B2 IL-12 modulatory compounds SYNTA PHARMACEUTICALS CORP. (US) 2012-08-07 — — US disclosed
US-20100256132-A1 IL-12 MODULATORY COMPOUNDS SYNTA PHARMACEUTICALS CORPORATION (US) 2010-10-07 — — US disclosed
US-7696202-B2 IL-12 modulatory compounds SYNTA PHARMACEUTICALS CORP. (US) 2010-04-13 — — US disclosed
EP-1819341-A2 IL-12 MODULATORY COMPOUNDS Synta Pharmaceuticals Corporation (US) 2007-08-22 — — EP disclosed
US-20060223996-A1 IL-12 modulatory compounds SYNTA PHARMACEUTICALS CORP. (US) 2006-10-05 — — US disclosed
WO-2006053227-A2 IL-12 MODULATORY COMPOUNDS SYNTA PHARMACEUTICALS CORP. (US) 2006-05-18 — — 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 (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-20060223996-A1 IL-12 modulatory compounds IL2, IL4, IFNG NAPEPLD 1303/4885MAPK1 1408/4885PIK3CA 2810/4885
US-20100256132-A1 IL-12 MODULATORY COMPOUNDS IL2, IL4, IFNG NAPEPLD 1303/4885MAPK1 1408/4885PIK3CA 2810/4885

“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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