SCHEMBL6766817

SCHEMBL6766817

COC(=O)C1(N(C(C)=O)c2c(F)cccc2Cl)CCN(C(C)C(=O)O)CC1

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 6/20 0.37
P2RX7 Q99572 11/20 0.36
EGFR P00533 1/20 0.35
CACNA1C Q13936 1/20 0.35
OPRD1 P41143 1/20 0.35
OPRK1 P41145 1/20 0.35
CXCR2 P25025 1/20 0.34

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
SCHEMBL6771258 0.93 OPRM1 (0.38) OPRM1P2RX7EGFRCACNA1COPRD1
SCHEMBL6850209 0.86 OPRM1 (0.40) OPRM1CACNA1COPRD1OPRK1CXCR2
SCHEMBL6850630 0.85 MEN1 (0.41) OPRM1CACNA1COPRD1OPRK1
SCHEMBL6766826 0.82 CACNA1C (0.48) OPRM1CACNA1COPRD1OPRK1
SCHEMBL6762264 0.78 FSCN1 (0.39) OPRM1P2RX7CACNA1COPRD1OPRK1
SCHEMBL6765258 0.78 OPRM1 (0.41) OPRM1CACNA1COPRD1OPRK1
SCHEMBL6767228 0.77 USP2 (0.39) OPRM1CACNA1COPRD1OPRK1
SCHEMBL6771752 0.76 OPRM1 (0.39) OPRM1CXCR2
SCHEMBL7160989 0.75 OPRM1 (0.49) OPRM1OPRD1OPRK1
SCHEMBL6766373 0.75 KMT2A (0.41) OPRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6774133-B2 Substituted spiroheterocyclic 1H-3-aryl-pyrrolidine-2,4-dione derivatives, processes for their preparation, and their use as pesticides BAYER AKTIENGESELLSCHAFT (DE) 2004-08-10 US disclosed
US-20040009999-A1 Substituted spiroheterocyclic 1H-3-aryl-pyrrolidine-2,4-dione derivatives, processes for their preparation, and their use as pesticides FISCHER REINER (DE) 2004-01-15 US disclosed
US-6555567-B1 2-oxo-3-aryl-4-hydroxy-1-aza-8-thiaspiro(4.5)decane derivatives of given formula; use as arthropodicide or nematicide BAYER AKTIENGESELLSCHAFT (DE) 2003-04-29 US disclosed
US-6479489-B1 AN ARTHROPODICIDAL OR NEMATICIDAL COMPOSITION BAYER AKTIENGESELLSCHAFT (DE) 2002-11-12 US disclosed
US-5981567-A ARTHROPODICIDAL OR NEMATICIDAL COMPOSITION BAYER AKTIENGESELLSCHAFT (DE) 1999-11-09 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-20040009999-A1 Substituted spiroheterocyclic 1H-3-aryl-pyrrolidine-2,4-dione derivatives, processes for their preparation, and their use as pesticides DDT, HPD, CAT OPRM1 2117/4885P2RX7 924/4885EGFR 3433/4885

“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.