SCHEMBL16515232

SCHEMBL16515232

Nc1cnccc1[C@@]1(NC(=O)O)CCCNC1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.37
▸ ALDH1A1 P00352 2/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ KDM6B O15054 1/20 0.37
▸ KDM4A O75164 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ THRB P10828 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ KDM4D Q6B0I6 1/20 0.37
▸ KDM4C Q9H3R0 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ NAMPT P43490 5/20 0.35
▸ GLA P06280 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ ROCK2 O75116 3/20 0.32
▸ ROCK1 Q13464 3/20 0.32
▸ CDC42BPB Q9Y5S2 3/20 0.32
▸ CDC42BPA Q5VT25 2/20 0.32
▸ MAP4K1 Q92918 2/20 0.31

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
SCHEMBL13734858 0.79 NAMPT (0.34) NAMPT
SCHEMBL13735091 0.79 NAMPT (0.32) NAMPT
SCHEMBL15874793 0.77 KDM4E (0.35) KDM4EALDH1A1MEN1KDM6BKDM4A
SCHEMBL15874745 0.75 KDM4E (0.33) KDM4EALDH1A1MEN1KDM6BKDM4A
SCHEMBL15874843 0.75 KDM4E (0.33) KDM4EALDH1A1MEN1KDM6BKDM4A
SCHEMBL16515363 0.74 ALDH1A1 (0.39) KDM4EALDH1A1MEN1MAPTKMT2A
SCHEMBL15874968 0.74 NAMPT (0.34) KDM4EALDH1A1MEN1KDM6BKDM4A
SCHEMBL4011286 0.71 SLC6A9 (0.50) HSD17B10SLC6A9
SCHEMBL22981916 0.70 SLC6A9 (0.41) KDM4EALDH1A1MAPTTDP1GAA
SCHEMBL15879994 0.69 CHEK1 (0.33) CHEK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3036238-A1 FURO- AND THIENO-PYRIDINE CARBOXAMIDE COMPOUNDS USEFUL AS PIM KINASE INHIBITORS Incyte Corporation (US) 2016-06-29 — — EP disclosed
WO-2016010897-A1 BICYCLIC HETEROAROMATIC CARBOXAMIDE COMPOUNDS USEFUL AS PIM KINASE INHIBITORS INCYTE CORPORATION (US) 2016-01-21 — — WO disclosed
WO-2015027124-A1 FURO- AND THIENO-PYRIDINE CARBOXAMIDE COMPOUNDS USEFUL AS PIM KINASE INHIBITORS INCYTE CORPORATION (US) 2015-02-26 — — WO disclosed
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