SCHEMBL6684559

SCHEMBL6684559

O=C(NCc1ccc(F)cc1)c1ccc2c(c1)C(=O)C(Cc1ccc(Cl)cc1)C(=O)N2

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.53
TP53 P04637 5/20 0.53
LMNA P02545 3/20 0.53
POLB P06746 4/20 0.47
CNR1 P21554 1/20 0.47
THRB P10828 2/20 0.44
RXFP1 Q9HBX9 1/20 0.44
RAB9A P51151 1/20 0.43
MEN1 O00255 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2C19 P33261 1/20 0.43
KMT2A Q03164 1/20 0.43
PTGER4 P35408 2/20 0.43
PPARG P37231 1/20 0.42
ROCK2 O75116 1/20 0.41
ROCK1 Q13464 1/20 0.41
PTGER2 P43116 1/20 0.41

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
SCHEMBL6684875 0.92 MAPT (0.49) MAPTTP53LMNAPOLBCNR1
SCHEMBL6679778 0.91 MAPT (0.47) MAPTTP53LMNAPOLBCNR1
SCHEMBL6678534 0.90 MAPT (0.48) MAPTTP53LMNAPOLBCNR1
SCHEMBL6683273 0.90 MAPT (0.49) MAPTTP53LMNAPOLBCNR1
SCHEMBL6680500 0.90 MAPT (0.47) MAPTTP53LMNAPOLBCNR1
SCHEMBL6678320 0.88 MAPT (0.55) MAPTTP53LMNAPOLBRAB9A
SCHEMBL6681366 0.87 MAPT (0.56) MAPTTP53LMNAPOLBCNR1
SCHEMBL6680173 0.84 ALDH1A1 (0.53) MAPTTP53LMNAPOLBTHRB
SCHEMBL6664864 0.83 MAPT (0.47) MAPTTP53LMNAPOLBCNR1
SCHEMBL6682598 0.82 MAPT (0.51) MAPTTP53LMNAPOLBRAB9A

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-20040043985-A1 6,6-Fused heteroaryl derivatives as matrix metalloproteinase inhibitors HICKS JAMES LESTER (US) 2004-03-04 US disclosed
WO-2004014388-A1 6,6-FUSED HETEROARYL 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-20040043985-A1 6,6-Fused heteroaryl derivatives as matrix metalloproteinase inhibitors MMP13, MMP26, MMP9 MAPT 2365/4885TP53 4473/4885LMNA 2566/4885

“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.