SCHEMBL15546643

SCHEMBL15546643

CC(=O)CC(=O)Nc1cc(F)c(N2CCOCC2)c(F)c1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ SHMT2 P34897 4/20 0.51
▸ L3MBTL1 Q9Y468 2/20 0.49
▸ AKT1 P31749 3/20 0.48
▸ RAB9A P51151 2/20 0.48
▸ NPC1 O15118 1/20 0.48
▸ ATM Q13315 2/20 0.46
▸ MAPT P10636 2/20 0.46
▸ GPR183 P32249 1/20 0.45
▸ PIK3CD O00329 1/20 0.44
▸ PIK3CA P42336 1/20 0.44
▸ PIK3CB P42338 1/20 0.44
▸ POLB P06746 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.44

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
SCHEMBL15546417 0.83 NPC1 (0.69) L3MBTL1RAB9ANPC1MAPTPOLB
SCHEMBL18770242 0.81 MAOA (0.46) SHMT2L3MBTL1AKT1RAB9ANPC1
SCHEMBL11026657 0.77 MAPT (0.70) RAB9ANPC1ATMMAPTPOLB
SCHEMBL20702982 0.75 ALDH1A1 (0.54) RAB9ANPC1ATMMAPTALDH1A1
SCHEMBL21999408 0.75 PDE3B (0.43) SHMT2L3MBTL1PIK3CBALDH1A1
SCHEMBL15545383 0.74 MAPT (0.68) L3MBTL1RAB9ANPC1MAPTPOLB
SCHEMBL16583835 0.73 MAPT (0.60) L3MBTL1AKT1RAB9ANPC1MAPT
SCHEMBL18787217 0.72 PRKDC (0.57) L3MBTL1RAB9ANPC1ATMMAPT
SCHEMBL20467962 0.71 NPC1 (0.54) SHMT2RAB9ANPC1MAPTPOLB
SCHEMBL23962394 0.71 ATM (0.60) L3MBTL1ATMMAPTPOLBALDH1A1

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-2875001-B1 NITROGENOUS HETEROCYCLIC DERIVATIVES AND THEIR APPLICATION IN DRUGS SUNSHINE LAKE PHARMA CO LTD (CN) 2019-01-09 — — EP disclosed
US-9434695-B2 Nitrogenous heterocyclic derivatives and their application in drugs SUNSHINE LAKE PHARMA CO., LTD (CN) 2016-09-06 — — US disclosed
EP-2875001-A1 NITROGENOUS HETEROCYCLIC DERIVATIVES AND THEIR APPLICATION IN DRUGS Sunshine Lake Pharma Co., Ltd. (CN) 2015-05-27 — — EP disclosed
US-20150087639-A1 Nitrogenous Heterocyclic Derivatives And Their Application In Drugs SUNSHINE LAKE PHARMA CO., LTD. (CN) 2015-03-26 — — US disclosed
WO-2014012360-A1 NITROGENOUS HETEROCYCLIC DERIVATIVES AND THEIR APPLICATION IN DRUGS SUNSHINE LAKE PHARMA CO., LTD. (CN) 2014-01-23 — — 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-20150087639-A1 Nitrogenous Heterocyclic Derivatives And Their Application In Drugs TNNC1, TNNI3, IAPP SHMT2 106/4885L3MBTL1 3927/4885AKT1 1123/4885

“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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