SCHEMBL21652237

SCHEMBL21652237

CC(C)(C)c1csc(-c2ccc(F)c(Cl)c2)n1

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.46
CNR2 P34972 1/20 0.46
ABL1 P00519 1/20 0.43
EIF4E P06730 10/20 0.40
EPHB4 P54760 2/20 0.39
PTGS2 P35354 2/20 0.38
TP53 P04637 1/20 0.37
NTMT1 Q9BV86 1/20 0.37
NISCH Q9Y2I1 1/20 0.36

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
SCHEMBL21652242 0.88 CNR1 (0.46) CNR1CNR2ABL1EIF4ENTMT1
SCHEMBL19625377 0.86 CNR1 (0.48) CNR1CNR2ABL1EIF4E
SCHEMBL21652239 0.86 RAB9A (0.46) CNR1CNR2EIF4ETP53NTMT1
SCHEMBL17124797 0.81 GFER (0.53) CNR1CNR2TP53NTMT1
SCHEMBL2662446 0.80 ABL1 (0.46) ABL1EIF4EEPHB4NISCH
SCHEMBL21652287 0.79 CNR1 (0.46) CNR1CNR2ABL1EIF4ENTMT1
SCHEMBL21652283 0.79 CYP19A1 (0.48) CNR1CNR2ABL1
SCHEMBL21652162 0.78 KDM4E (0.51) CNR1CNR2TP53NTMT1
SCHEMBL13996110 0.77 ABL1 (0.43) ABL1EIF4EEPHB4NISCH
SCHEMBL21652282 0.76 KDM4E (0.52) CNR1CNR2TP53NTMT1

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-10544092-B2 Malononitrile oxime ether compound and use thereof SHENYANG SINOCHEM AGROCHEMICALS R&D CO., LTD. (CN) 2020-01-28 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-10544092-B2 Malononitrile oxime ether compound and use thereof ME1, MAL2, ME3 CNR1 2295/4885CNR2 2550/4885ABL1 3029/4885

“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.