SCHEMBL7087035

SCHEMBL7087035

O=C(O)c1cc2c(F)c(O)ccc2n1Cc1ccc(F)c(C(F)(F)F)c1

nearest known ligand 0.67

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ABCB11 O95342 3/20 0.67
CCR2 P41597 15/20 0.53
CCR9 P51686 1/20 0.42
GPR35 Q9HC97 2/20 0.40

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
SCHEMBL7087122 0.89 ABCB11 (0.78) ABCB11CCR2
SCHEMBL7082977 0.87 ABCB11 (0.52) ABCB11CCR2
SCHEMBL7086981 0.87 CCR2 (0.51) ABCB11CCR2CCR9
SCHEMBL27585996 0.81 ABCB11 (0.44) ABCB11CCR2
SCHEMBL6598022 0.81 ABCB11 (1.00) ABCB11CCR2
SCHEMBL7082844 0.79 ABCB11 (0.69) ABCB11CCR2
SCHEMBL7084549 0.78 ABCB11 (0.64) ABCB11CCR2CCR9GPR35
SCHEMBL7082978 0.78 AR (0.41) ABCB11CCR2
SCHEMBL7135340 0.77 ABCB11 (0.60) ABCB11CCR2
SCHEMBL7089675 0.74 ABCB11 (0.48) ABCB11CCR2

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 6 patents. 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 claimed
CN-1395565-A Indole derivatives as MCP-1 receptor antagonists ASTRAZENECA AB (SE) 2003-02-05 CN claimed
EP-1252142-A1 INDOLE DERIVATIVES AS MCP-1 RECEPTOR ANTAGONISTS AstraZeneca AB (SE) 2002-10-30 EP claimed
WO-2001051466-A1 INDOLE DERIVATIVES AS MCP-1 RECEPTOR ANTAGONISTS ASTRAZENECA AB (SE) 2001-07-19 WO claimed
US-20030144339-A1 Indole derivatives as mcp-1 receptor antagonists ASTRAZENECA AB (SE) 2003-07-31 US disclosed
CN-1395565-A Indole derivatives as MCP-1 receptor antagonists ASTRAZENECA AB (SE) 2003-02-05 CN 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 391/4885CCR2 1/4885CCR9 10/4885

“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.