SCHEMBL5208637

SCHEMBL5208637

Cc1ccc(C(=O)O)c(NC(=O)Cc2c[nH]c3ccc(-c4cccc([N+](=O)[O-])c4)cc23)c1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ICMT O60725 3/20 0.49
CDK2 P24941 3/20 0.47
MAPT P10636 5/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
TRPM2 O94759 1/20 0.42
CNR2 P34972 1/20 0.42
MEN1 O00255 4/20 0.42
KMT2A Q03164 4/20 0.42
NQO2 P16083 1/20 0.41
PYGL P06737 1/20 0.41
ALDH1A1 P00352 2/20 0.41
ACLY P53396 1/20 0.41
TP53 P04637 1/20 0.41
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL5207800 0.84 ICMT (0.51) ICMTCDK2CNR2MEN1KMT2A
SCHEMBL5206707 0.83 ICMT (0.53) ICMTMAPTSMN1; SMN2CNR2ALDH1A1
SCHEMBL5211211 0.80 HTR1D (0.48) ICMTMAPTSMN1; SMN2CNR2ALDH1A1
SCHEMBL5213952 0.80 ICMT (0.47) ICMTMAPTSMN1; SMN2CNR2MEN1
SCHEMBL5210851 0.79 MAPT (0.60) CDK2MAPTSMN1; SMN2MEN1KMT2A
SCHEMBL5209045 0.79 CDK2 (0.49) ICMTCDK2MAPTSMN1; SMN2MEN1
SCHEMBL5210504 0.79 TSHR (0.56) ICMTMAPTSMN1; SMN2
SCHEMBL5213599 0.78 ICMT (0.61) ICMTMAPTCNR2MEN1KMT2A
SCHEMBL5207887 0.77 KDM4E (0.60) MAPTMEN1KMT2ANQO2ALDH1A1
SCHEMBL5214070 0.74 PPARG (0.57) MAPTSMN1; SMN2MEN1KMT2AALDH1A1

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
US-7288564-B2 Indole derivatives GLAXO GROUP LIMITED (GB) 2007-10-30 US claimed
EP-1343757-B1 INDOLE DERIVATIVES GLAXO GROUP LTD (GB) 2007-02-14 EP disclosed