SCHEMBL6662015

SCHEMBL6662015

O=C1CCC=CC1C(=O)c1cccc(C2=NOCC2)c1

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
F2 P00734 1/20 0.30
F10 P00742 1/20 0.30
PRSS1 P07477 1/20 0.30
FAAH O00519 1/20 0.30
NAAA Q02083 1/20 0.30

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
SCHEMBL703308 0.75 KMO (0.50)
SCHEMBL6658548 0.74 FAAH (0.33) FAAHNAAA
SCHEMBL2897989 0.73 MCL1 (0.51)
SCHEMBL6661445 0.70 PARP1 (0.35)
SCHEMBL6678037 0.68 BRD4 (0.30) F2F10PRSS1FAAHNAAA
SCHEMBL6658557 0.65 MCL1 (0.40)
SCHEMBL27911084 0.64 NISCH (0.39) FAAHNAAA
SCHEMBL700343 0.63 CHRNB4 (0.51)
SCHEMBL570014 0.61 CHRNB4 (0.42)
SCHEMBL3260882 0.60 MAPT (0.38)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1237881-B1 HERBICIDAL HALOGENALKYL-SUBSTITUTED 3-(4,5-DIHYDROISOXAZOL-3-YL)-BENZOYL-CYCLOHEXENONES BASF AG (DE) 2004-11-03 EP claimed
EP-1284969-B1 3-(4,5-DIHYDROISOXAZOLE-5-YL)BENZOYLCYCLOHEXENONES AND THE USE THEREOF AS HERBICIDES BASF AG (DE) 2004-08-18 EP claimed
US-20030199699-A1 3-(4,5-Dihydroisoxaxol-5-yl)benzoylcyclohexenones and the use thereof as herbicides BASF AKTIENGESELLSCHAFT (DE) 2003-10-23 US claimed
US-6599860-B1 Methods for controlling undesirable vegetation using the compounds BASF AKTIENGESELLSCHAFT (DE) 2003-07-29 US claimed
US-6599860-B1 Methods for controlling undesirable vegetation using the compounds BASF AKTIENGESELLSCHAFT (DE) 2003-07-29 US disclosed
US-6599860-B1 Methods for controlling undesirable vegetation using the compounds BASF AKTIENGESELLSCHAFT (DE) 2003-07-29 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-20030199699-A1 3-(4,5-Dihydroisoxaxol-5-yl)benzoylcyclohexenones and the use thereof as herbicides CBR3, HDHD5, CBR1 F2 4433/4885F10 2502/4885PRSS1 4639/4885

“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.