SCHEMBL2423959

SCHEMBL2423959

Cn1nnc2cc(/C=C3\SC(=O)NC3=O)ccc21

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CISD1 Q9NZ45 6/20 0.56
MAOB P27338 2/20 0.56
PIK3CD O00329 1/20 0.56
NPC1 O15118 1/20 0.56
CSNK2A2 P19784 1/20 0.56
PIK3CA P42336 1/20 0.56
PIK3CB P42338 1/20 0.56
MTOR P42345 1/20 0.56
PIK3CG P48736 1/20 0.56
CLK1 P49759 1/20 0.56
RAB9A P51151 1/20 0.56
CSNK2B P67870 1/20 0.56
CSNK2A1 P68400 1/20 0.56
DYRK1A Q13627 1/20 0.56
DYRK2 Q92630 1/20 0.56
DYRK1B Q9Y463 1/20 0.56
PIM1 P11309 10/20 0.54
PIM2 Q9P1W9 10/20 0.54
AKR1B1 P15121 5/20 0.54
PIM3 Q86V86 2/20 0.52

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
SCHEMBL2423961 1.00 CISD1 (0.56) CISD1MAOBPIK3CDNPC1CSNK2A2
SCHEMBL2883687 0.90 CISD1 (0.56) CISD1MAOBPIK3CDNPC1CSNK2A2
SCHEMBL2883684 0.90 CISD1 (0.56) CISD1MAOBPIK3CDNPC1CSNK2A2
SCHEMBL2884814 0.80 CISD1 (0.64) CISD1MAOBPIK3CDNPC1CSNK2A2
SCHEMBL2884813 0.80 CISD1 (0.64) CISD1MAOBPIK3CDNPC1CSNK2A2
SCHEMBL2427755 0.74 PIM1 (0.54) CISD1MAOBNPC1RAB9APIM1
SCHEMBL2427758 0.74 PIM1 (0.54) CISD1MAOBNPC1RAB9APIM1
SCHEMBL1525887 0.73 HCAR3 (0.54) NPC1RAB9AHPGD
SCHEMBL12975590 0.72 CISD1 (0.69) CISD1MAOBPIK3CDNPC1CSNK2A2
SCHEMBL2880250 0.72 CISD1 (0.69) CISD1MAOBPIK3CDNPC1CSNK2A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150051185-A1 Chemical Compounds 251 ASTRAZENECA AB (SE) 2015-02-19 US disclosed
US-20150051185-A1 Chemical Compounds 251 ASTRAZENECA AB (SE) 2015-02-19 US disclosed
US-20150051185-A1 Chemical Compounds 251 ASTRAZENECA AB (SE) 2015-02-19 US disclosed
US-8901307-B2 Chemical compounds 251 ASTRAZENECA AB (SE) 2014-12-02 US disclosed
US-8901307-B2 Chemical compounds 251 ASTRAZENECA AB (SE) 2014-12-02 US disclosed
US-8901307-B2 Chemical compounds 251 ASTRAZENECA AB (SE) 2014-12-02 US disclosed
US-20110218182-A1 CHEMICAL COMPOUNDS 251 ASTRAZENECA AB (SE) 2011-09-08 US disclosed
US-20110218182-A1 CHEMICAL COMPOUNDS 251 ASTRAZENECA AB (SE) 2011-09-08 US disclosed
US-20110218182-A1 CHEMICAL COMPOUNDS 251 ASTRAZENECA AB (SE) 2011-09-08 US 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 (2 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-20110218182-A1 CHEMICAL COMPOUNDS 251 PIM1, PIM3, PIM2 CISD1 4266/4885MAOB 2490/4885PIK3CD 483/4885
US-20150051185-A1 Chemical Compounds 251 PIM1, PIM3, PIM2 CISD1 4302/4885MAOB 2859/4885PIK3CD 507/4885

“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.