SCHEMBL6307840

SCHEMBL6307840

COc1cccc(Cn2c(C(=O)O)cc3ccc(F)cc32)c1

nearest known ligand 0.67

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 9/20 0.67
CCR9 P51686 2/20 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
KMT2A Q03164 1/20 0.50
TP53 P04637 1/20 0.48
MAPT P10636 1/20 0.48
THRB P10828 1/20 0.48
GPR35 Q9HC97 1/20 0.48
PPARG P37231 1/20 0.48
F10 P00742 1/20 0.48

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
SCHEMBL6303376 0.91 CCR2 (0.78) CCR2CCR9KDM4EALDH1A1LMNA
SCHEMBL3965499 0.91 CCR2 (0.73) CCR2CCR9KMT2ATP53MAPT
SCHEMBL6307185 0.87 CCR2 (0.69) CCR2CCR9ALDH1A1LMNAHPGD
SCHEMBL3956671 0.86 CCR2 (0.77) CCR2CCR9KMT2ATP53MAPT
SCHEMBL3956751 0.83 CCR2 (0.84) CCR2CCR9KDM4EALDH1A1HPGD
SCHEMBL6303500 0.82 CCR2 (0.73) CCR2CCR9GPR35
SCHEMBL6302379 0.81 CCR2 (0.68) CCR2CCR9KMT2AGPR35
SCHEMBL3664981 0.81 CCR2 (0.63) CCR2CCR9GPR35PPARG
SCHEMBL3967526 0.81 CCR2 (1.00) CCR2CCR9
SCHEMBL3963206 0.81 CCR2 (0.79) CCR2CCR9LMNAKMT2ATP53

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 5 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
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 4/4885CCR9 27/4885KDM4E 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.