SCHEMBL7083258

SCHEMBL7083258

CCOC(=O)c1c(Br)c2cc(OC(C)=O)ccc2n1Cc1ccc(Cl)c(C(F)(F)F)c1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ABCB11 O95342 2/20 0.43
GAA P10253 1/20 0.40
KDM4E B2RXH2 2/20 0.39
LMNA P02545 2/20 0.39
MAPT P10636 3/20 0.38
PTGS2 P35354 2/20 0.38
CCR2 P41597 1/20 0.38
PKM P14618 1/20 0.38
PLA2G2A P14555 1/20 0.38
PTGDR2 Q9Y5Y4 2/20 0.37
ELANE P08246 1/20 0.37
HPGD P15428 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
PTGER1 P34995 1/20 0.36
TP53 P04637 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
SCHEMBL7082951 0.93 ABCB11 (0.43) ABCB11GAAKDM4ELMNAMAPT
SCHEMBL7086861 0.90 GAA (0.41) GAAKDM4ELMNAMAPTPTGS2
SCHEMBL6780153 0.89 ABCB11 (0.54) ABCB11GAAKDM4ELMNAMAPT
SCHEMBL7089748 0.82 GAA (0.41) ABCB11GAAKDM4ELMNAMAPT
SCHEMBL7083815 0.81 ABCB11 (0.61) ABCB11KDM4EMAPTPTGS2CCR2
SCHEMBL6595452 0.80 ABCB11 (0.56) ABCB11GAAKDM4ELMNAMAPT
SCHEMBL6782383 0.80 ABCB11 (0.56) ABCB11GAAKDM4ELMNAMAPT
SCHEMBL7601514 0.78 GAA (0.41) ABCB11GAAKDM4ELMNAMAPT
SCHEMBL7592778 0.76 ABCB11 (0.61) ABCB11GAAKDM4ELMNAMAPT
SCHEMBL7084148 0.74 ABCB11 (0.61) ABCB11KDM4EMAPTPTGS2CCR2

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-20030144339-A1 Indole derivatives as mcp-1 receptor antagonists ASTRAZENECA AB (SE) 2003-07-31 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-20030144339-A1 Indole derivatives as mcp-1 receptor antagonists CCR2, CCR1, CCR5 ABCB11 391/4885GAA 4790/4885KDM4E 3030/4885

“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.