SCHEMBL7014092

SCHEMBL7014092

Nc1cc(Cl)c(Cl)nc1Nc1c[c]ccc1

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
BCL6 P41182 1/20 0.36
TYMS P04818 1/20 0.36
ALDH1A1 P00352 1/20 0.33
GAA P10253 1/20 0.33
ALOX15 P16050 1/20 0.33
HTT P42858 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
EGFR P00533 2/20 0.32
FBP1 P09467 1/20 0.32
KDR P35968 1/20 0.30
LMNA P02545 1/20 0.30

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
SCHEMBL7018790 0.86 ALDH1A1 (0.33) BCL6TYMSALDH1A1
SCHEMBL6384912 0.78 PIN1 (0.45) TYMSGAAHTTTDP1EGFR
SCHEMBL7016378 0.77 ALDH1A1 (0.34) ALDH1A1
SCHEMBL6384523 0.77 EGFR (0.38) BCL6HTTEGFRFBP1
SCHEMBL6426194 0.76 ALDH1A1 (0.37) BCL6ALDH1A1GAALMNA
SCHEMBL28147013 0.76 GAA (0.41) ALDH1A1GAAALOX15HTTTDP1
SCHEMBL7016784 0.72 ALDH1A1 (0.33) BCL6ALDH1A1
SCHEMBL7864714 0.72 MEN1 (0.35) EGFRLMNA
SCHEMBL6386562 0.71 PIK3CA (0.39) ALOX15HTTTDP1EGFR
SCHEMBL7012481 0.71 EGFR (0.36) TYMSEGFR

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1326606-A2 EP4 RECEPTOR INHIBITORS TO TREAT RHEUMATOID ARTHRITIS PFIZER PHARMACEUTICALS INC. (JP) 2003-07-16 EP disclosed
EP-1326864-A2 ARYL OR HETEROARYL FUSED IMIDAZOLE COMPOUNDS AS ANTI-INFLAMMATORY AND ANALGESIC AGENTS PFIZER PHARMACEUTICALS INC. (JP) 2003-07-16 EP disclosed
WO-2002032422-A2 EP4 RECEPTOR INHIBITORS TO TREAT RHEUMATOID ARTHRITIS PFIZER PHARMACEUTICALS INC. (JP) 2002-04-25 WO disclosed
WO-2002032900-A2 ARYL OR HETEROARYL FUSED IMIDAZOLE COMPOUNDS AS ANTI-INFLAMMATORY AND ANALGESIC AGENTS PFIZER PHARMACEUTICALS INC. (JP) 2002-04-25 WO disclosed