SCHEMBL6704883

SCHEMBL6704883

Cn1c(=O)n(Cc2ccc(F)cc2)c(=O)c2oc(C(=O)NCc3ccccc3)cc21

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 4/20 0.56
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
ALDH1A1 P00352 4/20 0.47
HPGD P15428 3/20 0.47
KDM4E B2RXH2 2/20 0.47
LMNA P02545 2/20 0.47
MAPT P10636 2/20 0.47
HTT P42858 2/20 0.47
CNR2 P34972 1/20 0.47
L3MBTL1 Q9Y468 2/20 0.46
TP53 P04637 1/20 0.46
NPSR1 Q6W5P4 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
POLB P06746 1/20 0.45

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
SCHEMBL6703433 0.82 TRPA1 (0.61) TRPA1MEN1KMT2AALDH1A1HPGD
SCHEMBL6700333 0.77 S1PR3 (0.48) TRPA1LMNAPOLB
SCHEMBL6465766 0.77 MMP13 (0.55) TRPA1MEN1KMT2AKDM4EMAPT
SCHEMBL6517292 0.75 MAPT (0.59) ALDH1A1HPGDKDM4EMAPTL3MBTL1
SCHEMBL7033633 0.75 TRPA1 (0.57) TRPA1MEN1KMT2AALDH1A1KDM4E
SCHEMBL6791261 0.74 TRPA1 (0.54) TRPA1MEN1KMT2AALDH1A1HPGD
SCHEMBL7095851 0.74 MMP13 (0.65) HPGDKDM4EMAPTL3MBTL1TP53
SCHEMBL7100567 0.73 MMP13 (0.56) HPGDKDM4EMAPTL3MBTL1TP53
SCHEMBL6730256 0.73 MAPT (0.52) MEN1KMT2AMAPTTP53POLB
SCHEMBL7021132 0.73 TRPA1 (0.57) TRPA1MAPTNPSR1SMN1; SMN2POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004014916-A1 PYRIMIDINE FUSED BICYCLIC METALLOPROTEINASE INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2004-02-19 WO claimed
US-20040038994-A1 Pyrimidine fused bicyclic metalloproteinase inhibitors WILSON MICHAEL WILLIAM (US) 2004-02-26 US disclosed
WO-2004014916-A1 PYRIMIDINE FUSED BICYCLIC METALLOPROTEINASE INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2004-02-19 WO 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-20040038994-A1 Pyrimidine fused bicyclic metalloproteinase inhibitors MMP9, MMP1, MMP2 TRPA1 4283/4885MEN1 4003/4885KMT2A 2485/4885

“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.