SCHEMBL17632245

SCHEMBL17632245

N#CN(C(=O)C1CCNC1)c1cnc2ccccc2c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 2/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ MGAM O43451 1/20 0.37
▸ KDM2B Q8NHM5 1/20 0.36
▸ PRKCZ Q05513 1/20 0.36
▸ NISCH Q9Y2I1 1/20 0.36
▸ PREP P48147 1/20 0.36
▸ CDK9 P50750 1/20 0.35
▸ KDM4E B2RXH2 2/20 0.35
▸ CHEK1 O14757 1/20 0.35
▸ MAP4K4 O95819 1/20 0.34
▸ CSNK1G2 P78368 1/20 0.34
▸ CLK4 Q9HAZ1 1/20 0.34
▸ MKNK2 Q9HBH9 1/20 0.34
▸ MAP4K5 Q9Y4K4 1/20 0.34
▸ HPGDS O60760 1/20 0.34

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
SCHEMBL17632154 1.00 RAB9A (0.38) RAB9AALDH1A1KMT2ASMN1; SMN2MEN1
SCHEMBL17632261 0.84 HPGDS (0.41) CDK9CHEK1HPGDS
SCHEMBL17632116 0.81 CDK9 (0.38) CDK9CHEK1
SCHEMBL17631936 0.80 USP30 (0.37) KDM2BCDK9CHEK1HPGDSCHRNB2
SCHEMBL17632621 0.76 ALDH1A1 (0.47) RAB9AALDH1A1KMT2ASMN1; SMN2MEN1
SCHEMBL17632600 0.76 CDK9 (0.39) ALDH1A1SMN1; SMN2CDK9KDM4E
SCHEMBL17632036 0.75 USP30 (0.50) CHEK1
SCHEMBL17631943 0.74 USP30 (0.49) CDK9CHEK1HPGDS
SCHEMBL17632326 0.74 USP30 (0.49) CDK9CHEK1HPGDS
SCHEMBL17631874 0.74 USP30 (0.51) CDK9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3197883-A1 NOVEL COMPOUNDS Mission Therapeutics Limited (GB) 2017-08-02 — — EP disclosed
WO-2016046530-A1 NOVEL COMPOUNDS MISSION THERAPEUTICS LTD (GB) 2016-03-31 — — WO disclosed
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