SCHEMBL659001

SCHEMBL659001

CC1(C)OB(c2cnn(C3CCN(CCS(C)(=O)=O)CC3)c2)OC1(C)C

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.39
OGA O60502 1/20 0.32
KDM1A O60341 1/20 0.32
JAK1 P23458 1/20 0.31
JAK3 P52333 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPK1 P28482 1/20 0.31
GSK3B P49841 2/20 0.31
DYRK1A Q13627 2/20 0.31
CDK1 P06493 1/20 0.30
CDK4 P11802 1/20 0.30
CCNB1 P14635 1/20 0.30
CCND1 P24385 1/20 0.30
CCNE1 P24864 1/20 0.30
CDK2 P24941 1/20 0.30
CCND3 P30281 1/20 0.30
CDK6 Q00534 1/20 0.30

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
SCHEMBL21292310 0.84 FFAR1 (0.41) FFAR1OGAGSK3BDYRK1A
SCHEMBL664758 0.83 CCNE1 (0.41) FFAR1JAK1JAK3CDK1CDK4
SCHEMBL21626900 0.83 FFAR1 (0.44) FFAR1GSK3BDYRK1A
SCHEMBL659996 0.82 FFAR1 (0.40) FFAR1GSK3BDYRK1A
SCHEMBL26602636 0.81 FFAR1 (0.39) FFAR1JAK1JAK3ALDH1A1
SCHEMBL657486 0.81 FFAR1 (0.44) FFAR1GSK3BDYRK1A
SCHEMBL21794911 0.80 FFAR1 (0.39) FFAR1OGAJAK1JAK3CDK1
SCHEMBL1987497 0.79 FFAR1 (0.49) FFAR1JAK1JAK3
SCHEMBL2322548 0.79 FFAR1 (0.46) FFAR1OGAJAK1JAK3GSK3B
SCHEMBL2998098 0.78 FFAR1 (0.41) FFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8378104-B2 7-aminofuropyridine derivatives OSI Pharmaceuticals, LLC (US) 2013-02-19 US disclosed
US-20120046267-A1 7-AMINOFUROPYRIDINE DERIVATIVES OSI PHARMACEUTICALS, INC. 2012-02-23 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 (1 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-20120046267-A1 7-AMINOFUROPYRIDINE DERIVATIVES MAP3K5, STK17A, MAPKAPK5 FFAR1 2193/4885OGA 2202/4885KDM1A 169/4885

“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.