SCHEMBL6016776

SCHEMBL6016776

Fc1c(Nc2ccc(Br)cc2Cl)ccc2[nH]cnc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 4/20 0.41
PKM P14618 1/20 0.36
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
ALDH1A1 P00352 3/20 0.35
MAPT P10636 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
PRNP P04156 1/20 0.35
HPGD P15428 1/20 0.35
HTT P42858 1/20 0.35
LMNA P02545 2/20 0.35
SMC2 O95347 1/20 0.35
CSNK2A2 P19784 1/20 0.35
MAP2K2 P36507 1/20 0.35
MAP2K1 Q02750 1/20 0.35
SMC1A Q14683 1/20 0.35
AAK1 Q2M2I8 1/20 0.35
Q6ZSR9 Q6ZSR9 1/20 0.35
BMP2K Q9NSY1 1/20 0.35
CTDSP1 Q9GZU7 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
SCHEMBL3861246 0.82 EGFR (0.34) EGFRPKMMEN1KMT2AALDH1A1
SCHEMBL3859991 0.79 EGFR (0.38) EGFRPKMMEN1KMT2AALDH1A1
SCHEMBL6727195 0.79 SRC (0.45) EGFRPKMMEN1KMT2AALDH1A1
SCHEMBL27670445 0.79 MAP2K1 (0.42) EGFRPKMMEN1KMT2AALDH1A1
SCHEMBL1076189 0.79 MAP2K1 (0.42) EGFRPKMMEN1KMT2AALDH1A1
SCHEMBL6016744 0.78 MAP2K1 (0.40) EGFRPKMMEN1KMT2AALDH1A1
SCHEMBL1038071 0.78 MAP2K1 (0.45) EGFRPKMMEN1KMT2ASMN1; SMN2
SCHEMBL18272624 0.77 MAP2K1 (0.49) EGFRPKMMEN1KMT2ASMN1; SMN2
SCHEMBL1041272 0.77 IDO1 (0.40) EGFRPKMMEN1KMT2AALDH1A1
SCHEMBL19141812 0.76 DPP4 (0.40) MEN1KMT2AALDH1A1MAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1482932-A4 N3 ALKYLATED BENZIMIDAZOLE DERIVATIVES AS MEK INHIBITORS ARRAY BIOPHARMA INC (US) 2006-04-05 EP disclosed
EP-1482932-A1 N3 ALKYLATED BENZIMIDAZOLE DERIVATIVES AS MEK INHIBITORS Array Biopharma, Inc. (US) 2004-12-08 EP disclosed
WO-2003077914-A1 N3 ALKYLATED BENZIMIDAZOLE DERIVATIVES AS MEK INHIBITORS ARRAY BIOPHARMA, INC (US) 2003-09-25 WO disclosed