SCHEMBL2595142

SCHEMBL2595142

Cc1ccc(C(=O)O)c2cc[nH]c12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AURKA O14965 2/20 0.46
TPX2 Q9ULW0 2/20 0.46
BRPF1 P55201 1/20 0.45
KEAP1 Q14145 1/20 0.44
GOT1 P17174 1/20 0.42
NR4A2 P43354 1/20 0.41
NOTUM Q6P988 1/20 0.39
CFB P00751 3/20 0.38
HAAO P46952 1/20 0.38
P2RX7 Q99572 3/20 0.37
ADRA2A P08913 1/20 0.37
CLCN2 P51788 1/20 0.37
CYP1A2 P05177 1/20 0.37
CSNK2A2 P19784 1/20 0.36
CSNK2B P67870 1/20 0.36
CSNK2A1 P68400 1/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HPGD P15428 1/20 0.36
HSD17B10 Q99714 1/20 0.36

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
SCHEMBL2768819 0.85 KEAP1 (0.49) AURKATPX2KEAP1GOT1NOTUM
SCHEMBL11660386 0.84 KEAP1 (0.55) AURKATPX2KEAP1NR4A2CYP1A2
SCHEMBL2589245 0.81 NR4A2 (0.60) BRPF1GOT1NR4A2P2RX7KDM4E
SCHEMBL15797435 0.79 AURKA (0.54) AURKATPX2KEAP1CFBP2RX7
SCHEMBL2424952 0.78 BTK (0.56) KEAP1
SCHEMBL21818677 0.78 KEAP1 (0.44) AURKATPX2KEAP1CFBP2RX7
SCHEMBL27205515 0.78 CSNK2A2 (0.46) AURKATPX2KEAP1NR4A2ADRA2A
SCHEMBL38661681 0.77 KEAP1 (0.45) AURKATPX2KEAP1GOT1NOTUM
SCHEMBL19644423 0.77 KDM4E (0.52) AURKATPX2KEAP1CFBP2RX7
SCHEMBL15797491 0.76 P2RX7 (0.55) AURKATPX2KEAP1P2RX7

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 53 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3246027-A1 INDOLE DERIVATIVES FOR THE TREATMENT OF CANCER GlaxoSmithKline LLC (US) 2017-11-22 EP disclosed
EP-3246027-A1 INDOLE DERIVATIVES FOR THE TREATMENT OF CANCER GlaxoSmithKline LLC (US) 2017-11-22 EP disclosed
US-9649307-B2 Indoles GLAXOSMITHKLINE LLC (US) 2017-05-16 US disclosed
US-9649307-B2 Indoles GLAXOSMITHKLINE LLC (US) 2017-05-16 US disclosed
US-9649307-B2 Indoles GLAXOSMITHKLINE LLC (US) 2017-05-16 US disclosed
EP-2566327-B1 INDOLES GLAXOSMITHKLINE LLC (US) 2017-03-29 EP disclosed
US-20160296518-A1 INDOLES GLAXOSMITHKLINE LLC 2016-10-13 US disclosed
US-20160296518-A1 INDOLES GLAXOSMITHKLINE LLC 2016-10-13 US disclosed
US-20160296518-A1 INDOLES GLAXOSMITHKLINE LLC 2016-10-13 US disclosed
US-9446041-B2 Method of treatment GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO. 2) LIMITED (GB) 2016-09-20 US disclosed
US-8536179-B2 Indoles GLAXOSMITHKLINE LLC (US) 2013-09-17 US disclosed
WO-2013067296-A1 METHOD OF TREATMENT GLAXOSMITHKLINE INTELLECTUAL PROPERTY (No 2) LIMITED (GB) 2013-05-10 WO disclosed
WO-2013067296-A1 METHOD OF TREATMENT GLAXOSMITHKLINE INTELLECTUAL PROPERTY (No 2) LIMITED (GB) 2013-05-10 WO disclosed
EP-2566327-A1 INDOLES GlaxoSmithKline LLC (US) 2013-03-13 EP disclosed
CN-102970869-A Indoles GLAXOSMITHKLINE LLC 2013-03-13 CN disclosed
US-20130053397-A1 INDOLES GLAXOSMITHKLINE LLC 2013-02-28 US disclosed
US-20130053397-A1 INDOLES GLAXOSMITHKLINE LLC 2013-02-28 US disclosed
US-20130053397-A1 INDOLES GLAXOSMITHKLINE LLC 2013-02-28 US disclosed
WO-2011140324-A1 INDOLES GLAXOSMITHKLINE LLC (US) 2011-11-10 WO disclosed
WO-2011140324-A1 INDOLES GLAXOSMITHKLINE LLC (US) 2011-11-10 WO disclosed

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

For each of this compound's patents that has machine-readable text (2 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-20130053397-A1 INDOLES IDO1, IDO2, INMT AURKA 206/4885TPX2 2757/4885BRPF1 3379/4885
US-20160296518-A1 INDOLES IDO1, IDO2, INMT AURKA 203/4885TPX2 2592/4885BRPF1 3506/4885

“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.