SCHEMBL3872270

SCHEMBL3872270

O=C(O)c1ccc2nc(F)n(CC3CCCO3)c2c1

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ GLP1R P43220 11/20 0.49
▸ PTGER4 P35408 1/20 0.49
▸ TSHR P16473 2/20 0.48
▸ KDM4C Q9H3R0 1/20 0.48
▸ ALDH1A1 P00352 1/20 0.47
▸ CTSD P07339 2/20 0.46
▸ HTT P42858 1/20 0.45

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
SCHEMBL30497392 0.94 GLP1R (0.49) GLP1RPTGER4
SCHEMBL28935425 0.86 PTGER4 (0.49) GLP1RPTGER4TSHRKDM4CALDH1A1
SCHEMBL28935420 0.86 PTGER4 (0.49) GLP1RPTGER4TSHRKDM4CALDH1A1
SCHEMBL31140564 0.82 PTGER4 (0.48) GLP1RPTGER4
SCHEMBL23980750 0.81 PTGER4 (0.52) GLP1RPTGER4
SCHEMBL29770328 0.81 PTGER4 (0.52) GLP1RPTGER4
SCHEMBL27478630 0.81 GLP1R (0.60) GLP1R
SCHEMBL29987259 0.81 KDM4C (0.54) GLP1RPTGER4TSHRKDM4CALDH1A1
SCHEMBL28789072 0.81 GLP1R (0.51) GLP1R
SCHEMBL29558920 0.81 KDM4C (0.54) GLP1RPTGER4TSHRKDM4CALDH1A1

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-1663210-A4 N3 ALKYLATED BENZIMIDAZOLE DERIVATIVES AS MEK INHIBITORS ARRAY BIOPHARMA INC (US) 2009-04-22 — — EP claimed
JP-2007504139-A — — 2007-03-01 — — JP claimed
EP-1663210-A1 N3 ALKYLATED BENZIMIDAZOLE DERIVATIVES AS MEK INHIBITORS Array Biopharma, Inc. (US) 2006-06-07 — — EP claimed
WO-2005023251-A1 N3 ALKYLATED BENZIMIDAZOLE DERIVATIVES AS MEK INHIBITORS ARRAY BIOPHARMA INC. (US) 2005-03-17 — — WO claimed
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