SCHEMBL6204309

SCHEMBL6204309

Cc1ccc(Cc2cc3c(cc2Nc2ccccc2)[N]C(=O)N3)c(C)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.40
NPC1 O15118 3/20 0.40
CXCR2 P25025 2/20 0.36
KMT2A Q03164 4/20 0.34
MAPT P10636 3/20 0.34
MEN1 O00255 3/20 0.34
NPSR1 Q6W5P4 3/20 0.34
LMNA P02545 2/20 0.34
EGFR P00533 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
CYP3A4 P08684 2/20 0.34
MAPK1 P28482 2/20 0.34
KDM4E B2RXH2 1/20 0.34
RGS12 O14924 1/20 0.34
GMNN O75496 1/20 0.34
PRKD3 O94806 1/20 0.34
ALDH1A1 P00352 1/20 0.34
PRKCG P05129 1/20 0.34
PRKCB P05771 1/20 0.34
GLA P06280 1/20 0.34

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
SCHEMBL6203101 0.87 NPC1 (0.38) RAB9ANPC1CXCR2KMT2AMAPT
SCHEMBL6203291 0.83 EGFR (0.39) KMT2AMAPTMEN1NPSR1LMNA
SCHEMBL6205665 0.81 EGFR (0.36) KMT2AMAPTMEN1NPSR1LMNA
SCHEMBL6204913 0.79 EGFR (0.42) MAPTEGFRMAPK1ALDH1A1SRC
SCHEMBL6204202 0.78 CXCR2 (0.36) CXCR2KMT2AMAPTMEN1NPSR1
SCHEMBL6204448 0.78 MAPT (0.34) KMT2AMAPTMEN1NPSR1LMNA
SCHEMBL6202957 0.78 ALDH1A1 (0.35) RAB9ACXCR2KMT2AMAPTMEN1
SCHEMBL6204330 0.78 CNR1 (0.39) CXCR2KMT2AMAPTMEN1NPSR1
SCHEMBL6202823 0.77 EGFR (0.42) KMT2AMAPTMEN1NPSR1LMNA
SCHEMBL6205611 0.77 MEN1 (0.38) KMT2AMAPTMEN1NPSR1LMNA

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-1539708-A1 BENZIMIDAZOLONES AND THEIR USE AS CYTOKINE INHIBITORS BOEHRINGER INGELHEIM PHARMACEUTICALS INC. (US) 2005-06-15 EP disclosed
WO-2004024699-A1 BENZIMIDAZOLONES AND THEIR USE AS CYTOKINE INHIBITORS BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2004-03-25 WO disclosed