SCHEMBL2882174

SCHEMBL2882174

O=C1NC(=O)C(=Cc2ccc3ncn(CCc4ccc(C(F)(F)F)cc4)c3c2)S1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 3/20 0.55
PIM2 Q9P1W9 2/20 0.55
PTPN1 P18031 11/20 0.54
CISD1 Q9NZ45 2/20 0.49
TTR P02766 1/20 0.49
PIK3CG P48736 2/20 0.49
MGAM O43451 1/20 0.48
GAA P10253 1/20 0.48
SI P14410 1/20 0.48
MGAM2 Q2M2H8 1/20 0.48
FOXM1 Q08050 1/20 0.47
PIK3CD O00329 1/20 0.46
NPC1 O15118 1/20 0.46
CSNK2A2 P19784 1/20 0.46
MAOB P27338 1/20 0.46
PIK3CA P42336 1/20 0.46
PIK3CB P42338 1/20 0.46
MTOR P42345 1/20 0.46
CLK1 P49759 1/20 0.46
RAB9A P51151 1/20 0.46

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
SCHEMBL2882172 1.00 PIM1 (0.55) PIM1PIM2PTPN1CISD1TTR
SCHEMBL2881861 0.90 PIM1 (0.57) PIM1PIM2PTPN1CISD1TTR
SCHEMBL2881863 0.90 PIM1 (0.57) PIM1PIM2PTPN1CISD1TTR
SCHEMBL6422799 0.87 HPGD (0.52) PIM1PIM2PTPN1CISD1PIK3CG
SCHEMBL2877670 0.87 HPGD (0.52) PIM1PIM2PTPN1CISD1PIK3CG
SCHEMBL2877667 0.87 HPGD (0.52) PIM1PIM2PTPN1CISD1PIK3CG
SCHEMBL2882113 0.83 HPGD (0.56) PTPN1CISD1PIK3CGMGAMGAA
SCHEMBL2882116 0.83 HPGD (0.56) PTPN1CISD1PIK3CGMGAMGAA
SCHEMBL2883617 0.82 PDE4B (0.58) PIM1PIM2MGAMGAASI
SCHEMBL2883618 0.82 PDE4B (0.58) PIM1PIM2MGAMGAASI

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 11 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

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 PIM1 2247/4885PIM2 2814/4885PTPN1 277/4885
US-20090042773-A1 P13 kinase gamma inhibitors for the treatment of anaemia PDPK1, PRKD3, PRKD1 PIM1 201/4885PIM2 264/4885PTPN1 436/4885
US-20050222225-A1 Use of compounds for increasing spermatozoa motility CATSPER1, PI4KB, MAN2B2 PIM1 2811/4885PIM2 2494/4885PTPN1 4272/4885
US-20080306057-A1 P13K Inhibitors for the Treatment of Endometriosis PDPK1, PIK3R4, MAP3K3 PIM1 864/4885PIM2 1010/4885PTPN1 639/4885
US-20060122176-A1 Azolidinone-vinyl fused-benzene derivatives BRCA1, ZAP70, F13B PIM1 2412/4885PIM2 2938/4885PTPN1 235/4885

“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.