SCHEMBL27469367

SCHEMBL27469367

Cc1cc(I)ccc1Nc1ccccc1C(=O)N(N)F

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.45
MAPK13 O15264 1/20 0.43
MAPK12 P53778 1/20 0.43
MAPK11 Q15759 1/20 0.43
MAPK14 Q16539 1/20 0.43
MAP2K1 Q02750 7/20 0.42
FABP4 P15090 1/20 0.39
MAP2K2 P36507 3/20 0.39
TAS2R14 Q9NYV8 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
AKR1C3 P42330 2/20 0.39
AKR1C2 P52895 2/20 0.39
AKR1B10 O60218 1/20 0.39
TRPA1 O75762 1/20 0.39
ABCB11 O95342 1/20 0.39
DHFR P00374 1/20 0.39
LMNA P02545 1/20 0.39
MPO P05164 1/20 0.39

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
SCHEMBL5677713 0.90 IDO1 (0.47) IDO1MAPK13MAPK12MAPK11MAPK14
SCHEMBL5386714 0.82 IDO1 (0.50) IDO1MAPK13MAPK12MAPK11MAPK14
SCHEMBL5677981 0.81 IDO1 (0.61) IDO1FABP4TAS2R14MEN1KMT2A
SCHEMBL7715685 0.80 IDO1 (0.48) IDO1MAPK13MAPK12MAPK11MAPK14
SCHEMBL27492881 0.79 IDO1 (0.47) IDO1MAPK13MAPK12MAPK11MAPK14
SCHEMBL6035367 0.74 IDO1 (0.48) IDO1MAP2K1MAP2K2KMT2ALMNA
SCHEMBL6694982 0.73 MAP2K1 (0.53) IDO1MAP2K1MAP2K2PTGS1PTGS2
SCHEMBL15603461 0.73 MAP2K1 (0.70) MAP2K1MAP2K2MEN1KMT2ATDP1
SCHEMBL5678007 0.73 IDO1 (0.70) IDO1MAP2K1MAP2K2MEN1KMT2A
SCHEMBL6035277 0.72 IDO1 (0.44) IDO1MAPK13MAPK12MAPK11MAPK14

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
CN-1149204-C 1-heterocyclic substituted diarylamines ��ʲ 2004-05-12 CN disclosed
CN-1334807-A 1-heterocycle substd. diarylamines WARNER LAMBERT CO (US) 2002-02-06 CN disclosed