SCHEMBL7855477

SCHEMBL7855477

CCOC(=O)c1c(CC)c2c(O)cccc2n1Cc1ccc(Cl)c(Cl)c1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.52
LMNA P02545 1/20 0.52
GAA P10253 1/20 0.52
MAPT P10636 1/20 0.52
HTT P42858 1/20 0.52
PLA2G2A P14555 2/20 0.47
CCR2 P41597 11/20 0.46
ABCB11 O95342 1/20 0.42
NOD2 Q9HC29 1/20 0.42
NOD1 Q9Y239 1/20 0.42
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
F10 P00742 2/20 0.40
PTGES O14684 1/20 0.40
ALOX5 P09917 1/20 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
SCHEMBL5215529 0.81 CCR2 (0.53) SMN1; SMN2LMNAGAAMAPTHTT
SCHEMBL5213680 0.77 CCR2 (0.65) SMN1; SMN2LMNAGAAMAPTHTT
SCHEMBL5214927 0.76 CCR2 (0.59) SMN1; SMN2LMNAGAAMAPTHTT
SCHEMBL8688955 0.76 CCR2 (0.59) SMN1; SMN2LMNAGAAMAPTHTT
SCHEMBL5216535 0.76 CCR2 (0.59) SMN1; SMN2LMNAGAAMAPTHTT
SCHEMBL5219665 0.76 CCR2 (0.56) SMN1; SMN2LMNAGAAMAPTHTT
SCHEMBL6302584 0.75 CCR2 (0.62) SMN1; SMN2LMNAGAAMAPTHTT
SCHEMBL5214863 0.75 CCR2 (0.76) SMN1; SMN2LMNAGAAMAPTHTT
SCHEMBL5213262 0.74 CCR2 (0.57) SMN1; SMN2LMNAGAAMAPTHTT
SCHEMBL5216641 0.74 MEN1 (0.63) SMN1; SMN2LMNAGAAMAPTHTT

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
EP-1150953-A1 INDOLE DERIVATIVES AND THEIR USE AS MCP-1 RECEPTOR ANTAGONISTS AstraZeneca AB (SE) 2001-11-07 EP disclosed
WO-2000046197-A1 INDOLE DERIVATIVES AND THEIR USE AS MCP-1 RECEPTOR ANTAGONISTS ASTRAZENECA AB (SE) 2000-08-10 WO disclosed