SCHEMBL4887599

SCHEMBL4887599

Cc1ccc(C(=O)NCCO)cc1-c1ccc(C(=O)NCC(C)(C)C)cc1C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
F7 P08709 11/20 0.46
F9 P00740 5/20 0.46
F11 P03951 3/20 0.46
F10 P00742 2/20 0.46
PLAU P00749 2/20 0.46
PRSS1 P07477 2/20 0.46
PRSS2 P07478 2/20 0.46
PRSS3 P35030 2/20 0.46
F2 P00734 1/20 0.46
MAPK14 Q16539 4/20 0.43
PDCD1 Q15116 1/20 0.42
CD274 Q9NZQ7 1/20 0.42
CNR2 P34972 1/20 0.42
POLB P06746 1/20 0.41
HPGD P15428 1/20 0.41
HTT P42858 1/20 0.41
METAP2 P50579 1/20 0.40
CHEK1 O14757 1/20 0.40

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
SCHEMBL4877481 0.90 MAPK14 (0.43) F7F9F11F10PLAU
SCHEMBL4883032 0.89 F7 (0.43) F7F9F11F10PLAU
SCHEMBL4884621 0.86 MAPK14 (0.53) F7F9F11F10PLAU
SCHEMBL4889383 0.82 F7 (0.48) F7F9F11F10PLAU
SCHEMBL14269642 0.79 MAPK14 (0.68) MAPK14
SCHEMBL14269659 0.77 MAPK14 (0.50) F7F9F11F10PLAU
SCHEMBL14269627 0.76 MAPK14 (0.54) MAPK14
SCHEMBL4887203 0.75 MAPK14 (0.52) MAPK14
SCHEMBL4883565 0.75 MAPK14 (0.50) F7MAPK14
SCHEMBL6275051 0.73 MAPK14 (0.54) MAPK14CNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080051416-A1 Novel Compounds SMITHKLINE BEECHAM CORPORATION (US) 2008-02-28 US disclosed
US-20080051416-A1 Novel Compounds SMITHKLINE BEECHAM CORPORATION (US) 2008-02-28 US disclosed
US-20080051416-A1 Novel Compounds SMITHKLINE BEECHAM CORPORATION (US) 2008-02-28 US disclosed
EP-1805132-A2 NOVEL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2007-07-11 EP disclosed
WO-2006110173-A2 NOVEL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2006-10-19 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 (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-20080051416-A1 Novel Compounds MAPK1, MAPKAPK2, MAPK6 F7 4712/4885F9 4810/4885F11 4083/4885

“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.