SCHEMBL2880080

SCHEMBL2880080

O=C1NC(=O)C(=Cc2ccc3ncn(Cc4ccoc4)c3c2)S1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 4/20 0.48
CISD1 Q9NZ45 4/20 0.48
PIK3CA P42336 3/20 0.48
NPC1 O15118 3/20 0.48
RAB9A P51151 3/20 0.48
PIK3CD O00329 2/20 0.48
CSNK2A2 P19784 2/20 0.48
PIK3CB P42338 2/20 0.48
MTOR P42345 2/20 0.48
CLK1 P49759 2/20 0.48
DYRK1A Q13627 2/20 0.48
MAOB P27338 2/20 0.48
CSNK2B P67870 1/20 0.48
CSNK2A1 P68400 1/20 0.48
DYRK2 Q92630 1/20 0.48
DYRK1B Q9Y463 1/20 0.48
MGAM O43451 1/20 0.47
GAA P10253 1/20 0.47
SI P14410 1/20 0.47
MGAM2 Q2M2H8 1/20 0.47

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
SCHEMBL2880079 1.00 PIK3CG (0.48) PIK3CGCISD1PIK3CANPC1RAB9A
SCHEMBL2882131 0.81 MTOR (0.47) PIK3CGCISD1PIK3CANPC1RAB9A
SCHEMBL2881861 0.81 PIM1 (0.57) PIK3CGCISD1PIK3CANPC1RAB9A
SCHEMBL2882136 0.81 MTOR (0.47) PIK3CGCISD1PIK3CANPC1RAB9A
SCHEMBL2881863 0.81 PIM1 (0.57) PIK3CGCISD1PIK3CANPC1RAB9A
SCHEMBL2877653 0.81 CISD1 (0.56) PIK3CGCISD1PIK3CANPC1RAB9A
SCHEMBL2877652 0.81 CISD1 (0.56) PIK3CGCISD1PIK3CANPC1RAB9A
SCHEMBL12975487 0.81 CISD1 (0.56) PIK3CGCISD1PIK3CANPC1RAB9A
SCHEMBL2883164 0.79 CISD1 (0.54) PIK3CGCISD1PIK3CANPC1RAB9A
SCHEMBL2883161 0.79 CISD1 (0.54) PIK3CGCISD1PIK3CANPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7846925-B2 Azolidinone-vinyl fused-benzene derivatives MERCK SERONO SA (CH) 2010-12-07 US claimed
US-20090042773-A1 P13 kinase gamma inhibitors for the treatment of anaemia MERCK SERONO SA (CH) 2009-02-12 US claimed
EP-1807075-A2 PI3 KINASE GAMMA INHIBITORS FOR THE TREATMENT OF ANAEMIA Applied Research Systems ARS Holding N.V. (AN) 2007-07-18 EP claimed
US-20060122176-A1 Azolidinone-vinyl fused-benzene derivatives MERCK SERONO SA (CH) 2006-06-08 US claimed
WO-2006040318-A2 PI3 KINASE GAMMA INHIBITORS FOR THE TREATMENT OF ANAEMIA APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) 2006-04-20 WO claimed
US-20050222225-A1 Use of compounds for increasing spermatozoa motility APPLIED RESEARCH SYSTEMS ARS HOLDING NV (NL) 2005-10-06 US claimed
US-7846925-B2 Azolidinone-vinyl fused-benzene derivatives MERCK SERONO SA (CH) 2010-12-07 US disclosed
US-20090306069-A1 AZOLIDINONE-VINYL FUSED-BENZENE DERIVATIVES LABORATOIRES SERONO S.A. (CH) 2009-12-10 US disclosed
US-20080306057-A1 P13K Inhibitors for the Treatment of Endometriosis LABORATORIES SERONO SA (CH) 2008-12-11 US disclosed
US-20060122176-A1 Azolidinone-vinyl fused-benzene derivatives MERCK SERONO SA (CH) 2006-06-08 US disclosed
US-20050222225-A1 Use of compounds for increasing spermatozoa motility APPLIED RESEARCH SYSTEMS ARS HOLDING NV (NL) 2005-10-06 US disclosed
EP-1549644-A1 AZOLIDINONE-VINYL FUSED-BENZENE DERIVATIVES Applied Research Systems ARS Holding N.V. (AN) 2005-07-06 EP disclosed
WO-2004007491-A1 AZOLIDINONE-VINYL FUSED-BENZENE DERIVATIVES APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) 2004-01-22 WO 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 (5 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-20090306069-A1 AZOLIDINONE-VINYL FUSED-BENZENE DERIVATIVES ZAP70, BRCA1, ZYX PIK3CG 1265/4885CISD1 2410/4885PIK3CA 619/4885
US-20090042773-A1 P13 kinase gamma inhibitors for the treatment of anaemia PDPK1, PRKD3, PRKD1 PIK3CG 52/4885CISD1 2142/4885PIK3CA 17/4885
US-20050222225-A1 Use of compounds for increasing spermatozoa motility CATSPER1, PI4KB, MAN2B2 PIK3CG 110/4885CISD1 4750/4885PIK3CA 130/4885
US-20080306057-A1 P13K Inhibitors for the Treatment of Endometriosis PDPK1, PIK3R4, MAP3K3 PIK3CG 52/4885CISD1 3440/4885PIK3CA 29/4885
US-20060122176-A1 Azolidinone-vinyl fused-benzene derivatives BRCA1, ZAP70, F13B PIK3CG 1318/4885CISD1 2197/4885PIK3CA 559/4885

“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.