SCHEMBL1759308

SCHEMBL1759308

Cc1[nH]c2ccc(F)cc2c1-c1ccc(=O)[nH]n1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.46
NFE2L2 Q16236 1/20 0.46
HTR2A P28223 1/20 0.45
HTR2C P28335 1/20 0.45
HTR7 P34969 1/20 0.45
HTR6 P50406 1/20 0.45
AKR1B1 P15121 3/20 0.41
LMNA P02545 2/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
CSF1R P07333 2/20 0.40
KDM4E B2RXH2 2/20 0.39
DRD4 P21917 1/20 0.39
MPO P05164 1/20 0.39
KIF11 P52732 1/20 0.39
ALDH1A1 P00352 1/20 0.39
GLA P06280 1/20 0.39
GAA P10253 1/20 0.39
HTT P42858 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
SCHEMBL1757597 0.74 LMNA (0.66) KEAP1NFE2L2HTR2AHTR2CHTR7
SCHEMBL31105587 0.70 MAP3K14 (0.60) HTR2AHTR2CHTR7HTR6KDM4E
SCHEMBL1757669 0.69 PTGDR2 (0.61) MEN1KMT2A
SCHEMBL27681973 0.69 PTGS2 (0.59) KEAP1NFE2L2HTR2AHTR2CHTR7
SCHEMBL8127718 0.68 KDM4E (0.57) KEAP1NFE2L2HTR2AHTR2CHTR7
SCHEMBL11468572 0.68 LMNA (0.62) KEAP1NFE2L2LMNASMN1; SMN2KDM4E
SCHEMBL30356394 0.67 MAPT (0.55) KEAP1NFE2L2HTR2AHTR2CHTR7
SCHEMBL10067335 0.67 MAPT (0.55) KEAP1NFE2L2HTR2AHTR2CHTR7
SCHEMBL25805760 0.67 KIF11 (0.55) KEAP1NFE2L2HTR2AHTR2CHTR7
SCHEMBL6824373 0.67 NISCH (0.55) KEAP1NFE2L2HTR2AHTR2CHTR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011055270-A1 INDOLE BASED RECEPTOR CRTH2 ANTAGONISTS WYETH LLC (US) 2011-05-12 WO disclosed