SCHEMBL2877124

SCHEMBL2877124

Cc1cc(Cl)ccc1Nc1c(C(=O)OC(C)(C)C)cc2[nH]c(C(N)=O)nc2c1F

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.41
ALDH1A1 P00352 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
PARP1 P09874 7/20 0.36
CSF1R P07333 2/20 0.34
NUDT1 P36639 1/20 0.34
MAP2K1 Q02750 2/20 0.33
CNR1 P21554 1/20 0.33
CNR2 P34972 1/20 0.33
PTGES O14684 2/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
GAA P10253 1/20 0.32

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
SCHEMBL3862127 0.74 MEN1 (0.55) PARP1MAP2K1MEN1KMT2ATDP1
SCHEMBL1040177 0.74 MEN1 (0.43) HPGDALDH1A1PARP1MAP2K1MEN1
SCHEMBL2885084 0.73 MAP2K1 (0.44) PARP1MAP2K1PTGESMEN1KMT2A
SCHEMBL13636440 0.73 ALDH1A1 (0.50) HPGDALDH1A1RAB9ASMN1; SMN2PARP1
SCHEMBL3860786 0.72 MEN1 (0.41) PARP1MAP2K1PTGESMEN1KMT2A
SCHEMBL1040434 0.72 NR4A2 (0.40) HPGDALDH1A1RAB9ASMN1; SMN2CSF1R
SCHEMBL2877121 0.71 PTGS2 (0.43) HPGDALDH1A1RAB9ASMN1; SMN2CSF1R
SCHEMBL17625884 0.71 ALDH1A1 (0.39) HPGDALDH1A1RAB9ASMN1; SMN2CSF1R
SCHEMBL3864888 0.71 MEN1 (0.40) PARP1MAP2K1PTGESMEN1KMT2A
SCHEMBL1042057 0.69 MAP2K1 (0.41) HPGDALDH1A1MAP2K1CNR2PTGES

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7842816-B2 N3 alkylated benzimidazole derivatives as MEK inhibitors ARRAY BIOPHARMA INC. (US) 2010-11-30 US claimed
EP-1663210-A4 N3 ALKYLATED BENZIMIDAZOLE DERIVATIVES AS MEK INHIBITORS ARRAY BIOPHARMA INC (US) 2009-04-22 EP claimed
US-20070299063-A1 N3 ALKYLATED BENZIMIDAZOLE DERIVATIVES AS MEK INHIBITORS ARRAY BIOPHARMA, INC. (US) 2007-12-27 US claimed
US-7235537-B2 N3 alkylated benzimidazole derivatives as MEK inhibitors ARRAY BIOPHARMA, INC. (US) 2007-06-26 US 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
US-20040116710-A1 N3 alkylated benzimidazole derivatives as MEK inhibitors ASTRAZENECA AB (SE) 2004-06-17 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070299063-A1 N3 ALKYLATED BENZIMIDAZOLE DERIVATIVES AS MEK INHIBITORS BRAF, CCNI, NRAS HPGD 2309/4885ALDH1A1 1591/4885RAB9A 278/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.