SCHEMBL3133596

SCHEMBL3133596

CC(Oc1cccc2ncccc12)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.50
FABP5 Q01469 1/20 0.46
MEN1 O00255 1/20 0.46
PPARG P37231 2/20 0.44
PPARA Q07869 2/20 0.44
CACNA2D1 P54289 10/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
HSD17B10 Q99714 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43

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
SCHEMBL6274946 1.00 KMT2A (0.50) KMT2AFABP5MEN1PPARGPPARA
SCHEMBL5756023 0.99 KMT2A (0.49) KMT2AFABP5MEN1PPARGPPARA
SCHEMBL5756012 0.99 KMT2A (0.49) KMT2AFABP5MEN1PPARGPPARA
SCHEMBL20045399 0.90 KMT2A (0.51) KMT2APPARGPPARA
SCHEMBL5756016 0.86 MEN1 (0.43) KMT2AFABP5MEN1CACNA2D1
SCHEMBL6313497 0.86 F9 (0.50) KMT2AFABP5MEN1CACNA2D1SMN1; SMN2
SCHEMBL5757213 0.86 F9 (0.50) KMT2AFABP5MEN1CACNA2D1SMN1; SMN2
SCHEMBL13318742 0.82 CACNA2D1 (0.42) KMT2AFABP5MEN1CACNA2D1
SCHEMBL2586363 0.81 CACNA2D1 (0.49) KMT2AMEN1CACNA2D1KDM4E
SCHEMBL6270120 0.78 KMT2A (0.49) KMT2AMEN1PPARGPPARAL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2024355-B1 ALKENE PIPERIDINE DERIVATIVES AS ANTIVIRAL AGENTS BRISTOL MYERS SQUIBB CO (US) 2010-07-14 EP disclosed
EP-2024355-B1 ALKENE PIPERIDINE DERIVATIVES AS ANTIVIRAL AGENTS BRISTOL MYERS SQUIBB CO (US) 2010-07-14 EP disclosed
US-7745463-B2 Alkene piperidine derivatives as antiviral agents BRISTOL-MYERS SQUIBB COMPANY (US) 2010-06-29 US disclosed
US-7745463-B2 Alkene piperidine derivatives as antiviral agents BRISTOL-MYERS SQUIBB COMPANY (US) 2010-06-29 US disclosed
US-7745463-B2 Alkene piperidine derivatives as antiviral agents BRISTOL-MYERS SQUIBB COMPANY (US) 2010-06-29 US disclosed
US-20090253741-A1 ALKENE PIPERIDINE DERIVATIVES AS ANTIVIRAL AGENTS BRISTOL-MYERS SQUIBB COMPANY 2009-10-08 US disclosed
US-20090253741-A1 ALKENE PIPERIDINE DERIVATIVES AS ANTIVIRAL AGENTS BRISTOL-MYERS SQUIBB COMPANY 2009-10-08 US disclosed
US-20090253741-A1 ALKENE PIPERIDINE DERIVATIVES AS ANTIVIRAL AGENTS BRISTOL-MYERS SQUIBB COMPANY 2009-10-08 US disclosed
US-7572810-B2 Alkene piperidine derivatives as antiviral agents BRISTOL-MYERS SQUIBB COMPANY (US) 2009-08-11 US disclosed
US-7572810-B2 Alkene piperidine derivatives as antiviral agents BRISTOL-MYERS SQUIBB COMPANY (US) 2009-08-11 US disclosed
US-7572810-B2 Alkene piperidine derivatives as antiviral agents BRISTOL-MYERS SQUIBB COMPANY (US) 2009-08-11 US disclosed
EP-2024355-A2 ALKENE PIPERIDINE DERIVATIVES AS ANTIVIRAL AGENTS Bristol-Myers Squibb Company (US) 2009-02-18 EP disclosed
WO-2007146550-A2 ALKENE PIPERIDINE DERIVATIVES AS ANTIVIRAL AGENTS BRISTOL-MYERS SQUIBB COMPANY (US) 2007-12-21 WO disclosed
WO-2007146550-A2 ALKENE PIPERIDINE DERIVATIVES AS ANTIVIRAL AGENTS BRISTOL-MYERS SQUIBB COMPANY (US) 2007-12-21 WO disclosed
US-20070287730-A1 Alkene Piperidine Derivatives as Antiviral Agents BRISTOL-MYERS SQUIBB COMPANY 2007-12-13 US disclosed
US-20070287730-A1 Alkene Piperidine Derivatives as Antiviral Agents BRISTOL-MYERS SQUIBB COMPANY 2007-12-13 US disclosed
US-20070287730-A1 Alkene Piperidine Derivatives as Antiviral Agents BRISTOL-MYERS SQUIBB COMPANY 2007-12-13 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-20090253741-A1 ALKENE PIPERIDINE DERIVATIVES AS ANTIVIRAL AGENTS EIF2AK2, ITPA, MAVS KMT2A 3595/4885FABP5 1908/4885MEN1 4847/4885
US-20070287730-A1 Alkene Piperidine Derivatives as Antiviral Agents EIF2AK2, ITPA, MAVS KMT2A 3595/4885FABP5 1908/4885MEN1 4847/4885

“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.