SCHEMBL30276642

SCHEMBL30276642

CC(C)(C)OC(=O)NC1C2CN(Cc3ccc(-n4ccc(NC(=O)N5CCNCC5)nc4=O)cc3C(F)(F)F)CC21

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 5/20 0.34
MKNK2 Q9HBH9 5/20 0.34
ABL1 P00519 4/20 0.34
BCR P11274 3/20 0.34
CYP3A4 P08684 2/20 0.34
RET P07949 5/20 0.33
CSF1R P07333 2/20 0.33
YES1 P07947 2/20 0.33
FGFR1 P11362 2/20 0.33
FLT1 P17948 2/20 0.33
FLT4 P35916 2/20 0.33
FLT3 P36888 2/20 0.33
MELK Q14680 2/20 0.33
NTRK2 Q16620 2/20 0.33
DDR2 Q16832 2/20 0.33
FAAH O00519 1/20 0.33
DDR1 Q08345 4/20 0.33
BTK Q06187 1/20 0.33
KDR P35968 3/20 0.33
SCN9A Q15858 1/20 0.32

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
SCHEMBL30276597 0.90 ATM (0.32) FAAHDDR1JAK1
SCHEMBL22235345 0.90 FAAH (0.35) MKNK1MKNK2ABL1BCRCYP3A4
SCHEMBL22249259 0.87 JAK1 (0.37) ABL1FAAHROCK2JAK1
SCHEMBL22236164 0.87 JAK1 (0.37) ABL1FAAHROCK2JAK1
SCHEMBL22249136 0.87 AOC3 (0.37) MKNK1MKNK2ABL1BCRCYP3A4
SCHEMBL22249126 0.87 AOC3 (0.37) MKNK1MKNK2ABL1BCRCYP3A4
SCHEMBL30276514 0.82 HRH3 (0.35) CYP3A4FAAHROCK2JAK1
SCHEMBL22254966 0.82 MKNK1 (0.40) MKNK1MKNK2ABL1BCRCYP3A4
SCHEMBL30276540 0.81 JAK1 (0.38) CYP3A4ROCK2NTRK1JAK1
SCHEMBL22235950 0.80 JAK1 (0.37) ABL1FAAHROCK2JAK1PRKAA1

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-20230072397-A1 Antimicrobial Compounds and Methods NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2023-03-09 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-20230072397-A1 Antimicrobial Compounds and Methods MPO, NISCH, RPN2 MKNK1 1209/4885MKNK2 1971/4885ABL1 117/4885

“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.