SCHEMBL6303376

SCHEMBL6303376

COc1cccc(Cn2c(C(=O)O)cc3cc(F)ccc32)c1

nearest known ligand 0.78

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 10/20 0.78
F10 P00742 1/20 0.58
KDM4E B2RXH2 1/20 0.54
ALDH1A1 P00352 1/20 0.54
LMNA P02545 1/20 0.54
HPGD P15428 1/20 0.54
CCR9 P51686 1/20 0.50
KMT2A Q03164 1/20 0.50

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
SCHEMBL6307840 0.91 CCR2 (0.67) CCR2F10KDM4EALDH1A1LMNA
SCHEMBL3956751 0.91 CCR2 (0.84) CCR2KDM4EALDH1A1HPGDCCR9
SCHEMBL3967526 0.87 CCR2 (1.00) CCR2CCR9
SCHEMBL3963206 0.87 CCR2 (0.79) CCR2LMNACCR9KMT2A
SCHEMBL6303307 0.87 CCR2 (0.76) CCR2KDM4EALDH1A1LMNAHPGD
SCHEMBL832189 0.87 CCR2 (0.71) CCR2F10KDM4EALDH1A1HPGD
SCHEMBL3956671 0.86 CCR2 (0.77) CCR2F10CCR9KMT2A
Hydrochloric Acid SCHEMBL926656 0.86 CCR2 (0.70) CCR2F10KDM4EALDH1A1HPGD
SCHEMBL6300900 0.85 CCR2 (0.65) CCR2F10KDM4EALDH1A1HPGD
SCHEMBL4371922 0.85 CCR2 (0.75) CCR2KDM4EALDH1A1LMNAHPGD

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-6953809-B2 Monocyte chemoattractant protein-1 inhibitor compounds ZENECA LIMITED (GB) 2005-10-11 US disclosed
EP-1003504-B1 INDOLE DERIVATIVES AND THEIR USE AS MCP-1 ANTAGONISTS ASTRAZENECA AB (SE) 2003-07-02 EP disclosed
US-20030119830-A1 Monocyte chemoattractant protein-1 inhibitor compounds ZENECA LIMITED 2003-06-26 US disclosed
US-6441004-B1 INDOLE DERIVATIVES AS ANTIINFLAMMATORY AGENTS ZENECA LIMITED (GB) 2002-08-27 US disclosed
EP-1003504-A2 INDOLE DERIVATIVES AND THEIR USE AS MCP-1 ANTAGONISTS AstraZeneca UK Limited (GB) 2000-05-31 EP disclosed
WO-1999007351-A2 INDOLE DERIVATIVES AND THEIR USE AS MCP-1 ANTAGONISTS ZENECA LIMITED (GB) 1999-02-18 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-20030119830-A1 Monocyte chemoattractant protein-1 inhibitor compounds CCL2, CCL11, CCR1 CCR2 4/4885F10 485/4885KDM4E 3717/4885

“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.