SCHEMBL6754372

SCHEMBL6754372

COc1ccc(COC(=O)c2ccc3c(c2)CN(C(C)c2ccc(C(=O)O)cc2)C(=O)N3)cc1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 12/20 0.43
NPC1 O15118 1/20 0.42
POLB P06746 1/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
RXRA P19793 1/20 0.40
RXRB P28702 1/20 0.40
PLA2G4B P0C869 1/20 0.39
MMP1 P03956 1/20 0.38
MMP9 P14780 1/20 0.38

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
SCHEMBL6747097 0.88 ALDH1A1 (0.43) MAPK1NPC1POLBRAB9ASMN1; SMN2
SCHEMBL6753606 0.87 POLB (0.41) MAPK1NPC1POLBRAB9ASMN1; SMN2
SCHEMBL6706802 0.86 NPC1 (0.51) MAPK1NPC1POLBRAB9ASMN1; SMN2
SCHEMBL6742558 0.82 MAPK1 (0.44) MAPK1
SCHEMBL6706821 0.77 MMP13 (0.51) MAPK1NPC1POLBRAB9ASMN1; SMN2
SCHEMBL6705942 0.76 ALDH1A1 (0.48) NPC1RAB9ASMN1; SMN2
SCHEMBL6765615 0.74 SMN1; SMN2 (0.50) NPC1POLBRAB9ASMN1; SMN2RXRA
SCHEMBL10636593 0.73 NPC1 (0.71) MAPK1NPC1POLBRAB9ASMN1; SMN2
SCHEMBL6765613 0.72 MEN1 (0.52) NPC1POLBRAB9ASMN1; SMN2PLA2G4B
SCHEMBL6706893 0.72 MAPK1 (0.45) MAPK1

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
US-20040043986-A1 5,6-Fused 3,4-dihydropyrimidine-2-one derivatives as matrix metalloproteinase inhibitors NAHRA JOE (US) 2004-03-04 US disclosed
WO-2004014869-A2 5,6-FUSED 3,4-DIHYDROPYRIMIDINE-2-ONE DERIVATIVES AS MATRIX 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-20040043986-A1 5,6-Fused 3,4-dihydropyrimidine-2-one derivatives as matrix metalloproteinase inhibitors MMP9, MMP13, MMP25 MAPK1 686/4885NPC1 2473/4885POLB 1091/4885

“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.