SCHEMBL23570969

SCHEMBL23570969

CC(C)C(=O)NC1CC(F)C1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.39
FASN P49327 1/20 0.35
MTNR1A P48039 1/20 0.35
MTNR1B P49286 1/20 0.35
GRM7 Q14831 3/20 0.32
SMYD3 Q9H7B4 1/20 0.32
ATM Q13315 2/20 0.31
PKM P14618 1/20 0.31
KDM5A P29375 1/20 0.31
KDM1A O60341 1/20 0.31

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
SCHEMBL13035557 0.80 EPHX2 (0.41) FASNMTNR1AMTNR1BGRM7
SCHEMBL16252563 0.80 FASN (0.36) FASNMTNR1AMTNR1BGRM7SMYD3
SCHEMBL15199663 0.80 FASN (0.36) FASNMTNR1AMTNR1BGRM7SMYD3
SCHEMBL12207205 0.80 FASN (0.36) FASNMTNR1AMTNR1BGRM7SMYD3
SCHEMBL12206769 0.80 FASN (0.36) FASNMTNR1AMTNR1BGRM7SMYD3
SCHEMBL25560389 0.78 FASN (0.41) FASNMTNR1AMTNR1BGRM7SMYD3
SCHEMBL22916971 0.78 ATM (0.48) FASNMTNR1AMTNR1BATM
SCHEMBL23570706 0.78 SMYD3 (0.30) SMYD3
SCHEMBL24758066 0.78 FASN (0.39) FASNMTNR1AMTNR1BPKM
SCHEMBL23571003 0.78 FASN (0.39) FASNMTNR1AMTNR1BPKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022263573-A1 ISOXAZOLINE PESTICIDES ELANCO TIERGESUNDHEIT AG (US) 2022-12-22 WO disclosed
US-20210188789-A1 ISOXAZOLINE DERIVATIVES ELANCO TIERGESUNDHEIT AG 2021-06-24 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-20210188789-A1 ISOXAZOLINE DERIVATIVES CYP3A7, CYP4X1, SIRT7 IDO1 72/4885FASN 2672/4885MTNR1A 1651/4885

“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.