SCHEMBL13034815

SCHEMBL13034815

CC(C)C(=O)NCCc1ncc[nH]1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TERT O14746 1/20 0.49
TBXAS1 P24557 2/20 0.45
SPR P35270 1/20 0.43
NAMPT P43490 3/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
KMT2A Q03164 1/20 0.42
PTGES O14684 4/20 0.41
TSHR P16473 1/20 0.40
RECQL P46063 1/20 0.40
HRH4 Q9H3N8 1/20 0.39
FPR2 P25090 1/20 0.39

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
SCHEMBL13380072 0.84 FPR2 (0.50) TBXAS1PTGESFPR2
SCHEMBL9081976 0.82 TERT (0.53) TERTTBXAS1NAMPTCYP2C19KMT2A
SCHEMBL7426540 0.80 TERT (0.54) TERTTBXAS1NAMPTFPR2
SCHEMBL17470979 0.79 SMN1; SMN2 (0.52) TERTTBXAS1NAMPTKMT2AFPR2
SCHEMBL434372 0.78 TERT (0.49) TERTTBXAS1NAMPTHRH4FPR2
SCHEMBL16133628 0.78 TERT (0.49) TERTTBXAS1NAMPTPTGESFPR2
SCHEMBL8278814 0.77 TBXAS1 (0.48) TERTTBXAS1NAMPTTSHR
SCHEMBL28985481 0.76 TBXAS1 (0.51) TERTTBXAS1NAMPT
SCHEMBL28308832 0.76 TERT (0.46) TERTTBXAS1NAMPTHRH4FPR2
SCHEMBL17713588 0.76 TERT (0.46) TERTTBXAS1NAMPTPTGESHRH4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100298314-A1 NOVEL JNK INHIBITORS SCHERING CORPORATION 2010-11-25 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-20100298314-A1 NOVEL JNK INHIBITORS MAPK1, MAPKAPK2, MAP4K2 TERT 1189/4885TBXAS1 529/4885SPR 3843/4885

“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.