SCHEMBL30387533

SCHEMBL30387533

CCn1c2nc(=O)n(C)c(=O)c-2nc2cc(C)c(OC)cc21

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP2 O95551 4/20 0.45
▸ TGM2 P21980 1/20 0.42
▸ TGM1 P22735 1/20 0.42
▸ CASP3 P42574 1/20 0.42
▸ TGM3 Q08188 1/20 0.42
▸ GSR P00390 5/20 0.39
▸ HSF1 Q00613 2/20 0.38
▸ KDM4E B2RXH2 3/20 0.38
▸ MAPT P10636 3/20 0.38
▸ HTT P42858 3/20 0.38
▸ SMN1; SMN2 Q16637 3/20 0.38
▸ POLB P06746 2/20 0.38
▸ THRB P10828 2/20 0.38
▸ RAB9A P51151 2/20 0.38
▸ GALK1 P51570 2/20 0.38
▸ BLM P54132 2/20 0.38
▸ NPSR1 Q6W5P4 2/20 0.38
▸ PTPN22 Q9Y2R2 2/20 0.38
▸ L3MBTL1 Q9Y468 2/20 0.38
▸ MEN1 O00255 2/20 0.38

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
SCHEMBL27033894 0.87 KDM4E (0.48) TDP2GSRHSF1KDM4EMAPT
SCHEMBL19415772 0.73 KDM4E (0.43) TDP2GSRKDM4EMAPTHTT
SCHEMBL16476446 0.73 KDM4E (0.43) TDP2GSRKDM4EMAPTHTT
Iodide SCHEMBL17254512 0.72 KDM4E (0.43) TDP2GSRHSF1KDM4EMAPT
SCHEMBL14399199 0.72 SMN1; SMN2 (0.58) TDP2GSRKDM4EMAPTHTT
SCHEMBL864002 0.71 MAPT (0.44) KDM4EMAPTHTTSMN1; SMN2MEN1
SCHEMBL16476438 0.69 HSF1 (0.41) TDP2GSRHSF1KDM4EMAPT
SCHEMBL864708 0.69 KDM4E (0.43) GSRKDM4EMAPTHTTSMN1; SMN2
SCHEMBL16479714 0.68 KDM4E (0.46) KDM4EMAPTHTTSMN1; SMN2THRB
SCHEMBL11307834 0.67 SMN1; SMN2 (0.48) TDP2GSRKDM4EMAPTHTT

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-116034167-A LASH method for single molecule sequencing and target nucleic acid detection 萨摩尔股份有限公司 2023-04-28 — — CN disclosed
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