SCHEMBL8229677

SCHEMBL8229677

C[C@@H](O)CCCCn1c(=O)c2nsnc2n(C)c1=O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TNF P01375 6/20 0.67
▸ LMNA P02545 4/20 0.36
▸ PDE4A P27815 3/20 0.36
▸ CYP1A2 P05177 2/20 0.36
▸ NFKB1 P19838 2/20 0.36
▸ ACHE P22303 2/20 0.36
▸ PMP22 Q01453 2/20 0.36
▸ PDE4B Q07343 2/20 0.36
▸ PDE4C Q08493 2/20 0.36
▸ PDE4D Q08499 2/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ USP2 O75604 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ ADORA2B P29275 1/20 0.36
▸ RXFP1 Q9HBX9 1/20 0.36
▸ GRM4 Q14833 1/20 0.34
▸ NPSR1 Q6W5P4 2/20 0.33
▸ ESR1 P03372 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ BLM P54132 1/20 0.33

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
SCHEMBL6347000 0.80 ADORA2A (0.50) TNFLMNAPDE4ACYP1A2NFKB1
SCHEMBL681591 0.80 ADORA2A (0.50) TNFLMNAPDE4ACYP1A2NFKB1
SCHEMBL681596 0.80 ADORA2A (0.50) TNFLMNAPDE4ACYP1A2NFKB1
SCHEMBL8071864 0.78 TNF (0.57) TNFLMNAPDE4ACYP1A2NFKB1
SCHEMBL681558 0.74 TNF (0.41) TNFLMNAPDE4ACYP1A2NFKB1
SCHEMBL19975702 0.74 TNF (0.46) TNFLMNAPDE4ACYP1A2NFKB1
SCHEMBL681598 0.74 TNF (0.41) TNFLMNAPDE4ACYP1A2NFKB1
SCHEMBL6346533 0.74 TNF (0.41) TNFLMNAPDE4ACYP1A2NFKB1
SCHEMBL8126411 0.74 TNF (0.46) TNFLMNAPDE4ACYP1A2NFKB1
SCHEMBL19975701 0.74 TNF (0.46) TNFLMNAPDE4ACYP1A2NFKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130122050-A1 COMPOSITIONS AND METHODS FOR TREATING DIABETES USING LISOFYLLINE ANALOGS AND ISLET NEOGENESIS ASSOCIATED PEPTIDE DIAKINE THERAPEUTICS, INC. (US) 2013-05-16 — — US disclosed
US-20130122050-A1 COMPOSITIONS AND METHODS FOR TREATING DIABETES USING LISOFYLLINE ANALOGS AND ISLET NEOGENESIS ASSOCIATED PEPTIDE DIAKINE THERAPEUTICS, INC. (US) 2013-05-16 — — US disclosed
US-20090269313-A1 ENCAPSULATION SYSTEM DIAKINE THERAPEUTICS, INC. (US) 2009-10-29 — — US disclosed
US-20090269313-A1 ENCAPSULATION SYSTEM DIAKINE THERAPEUTICS, INC. (US) 2009-10-29 — — US disclosed
US-20080300189-A1 PHARMACEUTICAL COMPOSITIONS AND METHODS FOR RESTORING BETA-CELL MASS AND FUNCTION DIAKINE THERAPEUTICS, INC. (US) 2008-12-04 — — US disclosed
WO-2007146786-A1 PHARMACEUTICAL COMPOSITIONS AND METHODS FOR RESTORING B-CELL MASS AND FUNCTION DIAKINE THERAPEUTICS, INC. (US) 2007-12-21 — — 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 (3 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-20130122050-A1 COMPOSITIONS AND METHODS FOR TREATING DIABETES USING LISOFYLLINE ANALOGS AND ISLET NEOGENESIS ASSOCIATED PEPTIDE IAPP, LITAF, IGF2BP1 TNF 673/4885LMNA 376/4885PDE4A 1788/4885
US-20090269313-A1 ENCAPSULATION SYSTEM GPR119, IAPP, LIPA TNF 1974/4885LMNA 311/4885PDE4A 4419/4885
US-20080300189-A1 PHARMACEUTICAL COMPOSITIONS AND METHODS FOR RESTORING BETA-CELL MASS AND FUNCTION IAPP, PNLIP, AMY2A TNF 843/4885LMNA 1488/4885PDE4A 328/4885

“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.

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