SCHEMBL28695464

SCHEMBL28695464

COC(=O)c1cnn(CCCc2ccccc2)c1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.47
▸ EHMT2 Q96KQ7 1/20 0.47
▸ FAAH O00519 3/20 0.46
▸ NAMPT P43490 1/20 0.46
▸ CYP4A11 Q02928 3/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ MGLL Q99685 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ KDM1A O60341 1/20 0.44
▸ HDAC6 Q9UBN7 1/20 0.44
▸ CES1 P23141 2/20 0.44
▸ CYP4F2 P78329 2/20 0.43
▸ MMP2 P08253 1/20 0.43
▸ DGAT1 O75907 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
SCHEMBL1946431 0.87 ALDH1A1 (0.52) KDM4ECYP4A11L3MBTL1ALDH1A1CYP4F2
SCHEMBL948290 0.85 L3MBTL1 (0.58) KDM4ENAMPTCYP4A11L3MBTL1ALDH1A1
SCHEMBL3765456 0.83 KLKB1 (0.53) KDM4EL3MBTL1ALDH1A1
SCHEMBL25123666 0.83 GBA1 (0.47) CYP4A11L3MBTL1CYP4F2
SCHEMBL949478 0.82 HDAC6 (0.46) KDM4ENAMPTL3MBTL1ALDH1A1KDM1A
SCHEMBL27645962 0.80 L3MBTL1 (0.55) KDM4EL3MBTL1MGLLALDH1A1
SCHEMBL19434598 0.80 LMNA (0.42) L3MBTL1HDAC6
SCHEMBL15175618 0.79 MAPT (0.47) KDM4ECYP4A11ALDH1A1CYP4F2
SCHEMBL7315645 0.78 L3MBTL1 (0.53) KDM4EL3MBTL1MGLLALDH1A1
SCHEMBL24842016 0.78 L3MBTL1 (0.45) KDM4ECYP4A11L3MBTL1ALDH1A1HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114026068-A EP2 antagonists 小野药品工业株式会社 2022-02-08 — — CN disclosed
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