SCHEMBL6695277

SCHEMBL6695277

CC(=NOCc1ccccc1CNC(=O)O)C(=O)c1ccc(F)cc1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 1/20 0.40
BCHE P06276 8/20 0.39
S1PR1 P21453 2/20 0.39
ALDH1A1 P00352 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
PLA2G1B P04054 1/20 0.37
ATG4B Q9Y4P1 1/20 0.37
PPARG P37231 1/20 0.37
PPARA Q07869 1/20 0.37
HPGD P15428 2/20 0.37
HTT P42858 1/20 0.37
KDM4E B2RXH2 1/20 0.37
PTPRC P08575 1/20 0.36
PTPN1 P18031 1/20 0.36
LMNA P02545 1/20 0.36
PTBP1 P26599 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
SCHEMBL6696501 0.84 PTGS2 (0.47) PTGS2BCHES1PR1ALDH1A1SMN1; SMN2
SCHEMBL6696504 0.84 PTGS2 (0.47) PTGS2BCHES1PR1ALDH1A1SMN1; SMN2
SCHEMBL6695273 0.78 PTGS2 (0.37) PTGS2S1PR1ALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL6694105 0.76 PTGS2 (0.36) PTGS2S1PR1ALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL6695718 0.76 PTGS2 (0.36) PTGS2S1PR1ALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL6693044 0.71 PTGS2 (0.44) PTGS2ALDH1A1SMN1; SMN2L3MBTL1PPARG
SCHEMBL6693047 0.71 PTGS2 (0.44) PTGS2ALDH1A1SMN1; SMN2L3MBTL1PPARG
SCHEMBL6696644 0.71 PTGS2 (0.44) PTGS2ALDH1A1SMN1; SMN2L3MBTL1PPARG
SCHEMBL6696646 0.71 PTGS2 (0.44) PTGS2ALDH1A1SMN1; SMN2L3MBTL1PPARG
SCHEMBL2863838 0.70 NPC1 (0.49) S1PR1ALDH1A1SMN1; SMN2L3MBTL1PPARG

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-20040023806-A1 N-phenylcarbamates having a microbicide insecticide and acaricide effect BAYER AKTIENGESELLSCHAFT (DE) 2004-02-05 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-20040023806-A1 N-phenylcarbamates having a microbicide insecticide and acaricide effect CBR3, CBR1, CYP1B1 PTGS2 4199/4885BCHE 185/4885S1PR1 1163/4885

“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.