SCHEMBL4877481

SCHEMBL4877481

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

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 9/20 0.43
F7 P08709 2/20 0.42
F2 P00734 1/20 0.42
F9 P00740 1/20 0.42
F10 P00742 1/20 0.42
PLAU P00749 1/20 0.42
F11 P03951 1/20 0.42
PRSS1 P07477 1/20 0.42
PRSS2 P07478 1/20 0.42
PRSS3 P35030 1/20 0.42
CNR2 P34972 1/20 0.41
HPGD P15428 2/20 0.40
POLB P06746 1/20 0.40
HTT P42858 1/20 0.40
PDCD1 Q15116 1/20 0.39
CD274 Q9NZQ7 1/20 0.39
METAP2 P50579 1/20 0.39
TERT O14746 2/20 0.39
MMP13 P45452 1/20 0.38
HSPB1 P04792 1/20 0.38

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
SCHEMBL4887599 0.90 F7 (0.46) MAPK14F7F2F9F10
SCHEMBL4883032 0.88 F7 (0.43) MAPK14F7F2F9F10
SCHEMBL14269659 0.86 MAPK14 (0.50) MAPK14F7F2F9F10
SCHEMBL14269627 0.86 MAPK14 (0.54) MAPK14HSPB1CYP2C9MAPK11
SCHEMBL4883565 0.81 MAPK14 (0.50) MAPK14F7HSPB1CYP2C9MAPK11
SCHEMBL14269662 0.81 MAPK14 (0.49) MAPK14F7F2F9F10
SCHEMBL6275051 0.80 MAPK14 (0.54) MAPK14CNR2HSPB1CYP2C9MAPK11
SCHEMBL14269642 0.79 MAPK14 (0.68) MAPK14HSPB1CYP2C9MAPK11
SCHEMBL6275542 0.77 SMPD1 (0.42) MAPK14F7F2F9F10
SCHEMBL5488332 0.77 MAPK14 (0.59) MAPK14HPGDPOLBHTTMMP13

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 3 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

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 MAPK14 23/4885F7 4712/4885F2 4746/4885

“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.