SCHEMBL418094

SCHEMBL418094

O=C(COCc1ccccc1)Nc1cccc(F)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.60
KMT2A Q03164 3/20 0.60
PTPRC P08575 1/20 0.60
PTPN1 P18031 1/20 0.60
MAPT P10636 2/20 0.58
POLB P06746 1/20 0.58
MAPK1 P28482 1/20 0.58
LRRK2 Q5S007 1/20 0.53
RAB9A P51151 2/20 0.52
NPC1 O15118 1/20 0.52
HPGD P15428 1/20 0.52
NAMPT P43490 1/20 0.52
PARP1 P09874 1/20 0.52
GAA P10253 1/20 0.51
XBP1 P17861 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
MGLL Q99685 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.49
ALDH1A1 P00352 1/20 0.49

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
SCHEMBL7646959 0.92 MEN1 (0.54) MEN1KMT2APTPRCPTPN1MAPT
SCHEMBL839348 0.85 NAMPT (0.66) MEN1KMT2APTPRCPTPN1MAPT
SCHEMBL415057 0.84 NAMPT (0.62) MEN1KMT2APTPRCPTPN1MAPT
SCHEMBL25547337 0.83 PTPRC (0.60) MEN1KMT2APTPRCPTPN1MAPT
SCHEMBL13316189 0.83 MAPK1 (0.67) MEN1KMT2APTPRCPTPN1MAPT
SCHEMBL7649333 0.83 PTPRC (0.60) MEN1KMT2APTPRCPTPN1MAPT
SCHEMBL964881 0.83 MEN1 (0.78) MEN1KMT2APTPRCPTPN1MAPT
SCHEMBL2349758 0.82 NAMPT (0.70) KMT2APTPRCPTPN1MAPTMAPK1
SCHEMBL20218964 0.80 PTPRC (0.59) MEN1KMT2APTPRCPTPN1MAPT
SCHEMBL20210585 0.80 PTPRC (0.59) MEN1KMT2APTPRCPTPN1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2411362-B1 Tricyclic indole derivatives as PBR ligands GE HEALTHCARE LTD (GB) 2017-05-31 EP disclosed
CN-103179991-B In vivo imaging method for cancer 通用电气健康护理有限公司 2016-08-24 CN disclosed
US-9314541-B2 In vivo imaging method for cancer GE HEALTHCARE LIMITED (GB) 2016-04-19 US disclosed
US-9220795-B2 Indole derivatives GE HEALTHCARE LIMITED (GB) 2015-12-29 US disclosed
US-9168317-B2 In vivo imaging method of mood disorders GE HEALTHCARE LIMITED (GB) 2015-10-27 US disclosed
US-20140364615-A1 INDOLE DERIVATIVES GE HEALTHCARE LIMITED (GB) 2014-12-11 US disclosed
US-8790619-B2 Indole derivatives GE HEALTHCARE LIMITED (GB) 2014-07-29 US disclosed
EP-2621544-A1 IN VIVO IMAGING METHOD FOR CANCER GE Healthcare UK Limited (GB) 2013-08-07 EP disclosed
EP-2618850-A1 IN VIVO IMAGING METHOD OF MOOD DISORDERS GE Healthcare UK Limited (GB) 2013-07-31 EP disclosed
US-20130183240-A1 IN VIVO IMAGING METHOD FOR CANCER GE HEALTHCARE LIMITED (GB) 2013-07-18 US disclosed
CN-103209713-A In vivo imaging method of mood disorders GE HEALTHCARE LTD 2013-07-17 CN disclosed
US-20130177501-A1 IN VIVO IMAGING METHOD OF MOOD DISORDERS GE HEALTHCARE LIMITED (GB) 2013-07-11 US disclosed
CN-103179991-A In vivo imaging method for cancer GE HEALTHCARE LTD 2013-06-26 CN disclosed
WO-2012041953-A1 IN VIVO IMAGING METHOD FOR CANCER GE HEALTHCARE LIMITED (GB) 2012-04-05 WO disclosed
WO-2012038532-A1 IN VIVO IMAGING METHOD OF MOOD DISORDERS GE HEALTHCARE LIMITED (GB) 2012-03-29 WO disclosed
EP-2411362-A2 INDOLE DERIVATIVES GE Healthcare UK Limited (GB) 2012-02-01 EP disclosed
US-20120020884-A1 INDOLE DERIVATIVES GE HEALTHCARE LIMITED (GB) 2012-01-26 US disclosed
WO-2010109007-A2 INDOLE DERIVATIVES GE HEALTHCARE LIMITED (GB) 2010-09-30 WO disclosed
US-6482985-B1 2-benzyloxy-5-halo-acylanilide compounds and method of using them EASTMAN KODAK COMPANY 2002-11-19 US 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 (4 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-20120020884-A1 INDOLE DERIVATIVES IDO1, IDO2, INMT MEN1 334/4885KMT2A 326/4885PTPRC 4293/4885
US-20130183240-A1 IN VIVO IMAGING METHOD FOR CANCER MKI67, PBRM1, BRD4 MEN1 1142/4885KMT2A 1543/4885PTPRC 3153/4885
US-20140364615-A1 INDOLE DERIVATIVES IDO1, IDO2, INMT MEN1 334/4885KMT2A 326/4885PTPRC 4293/4885
US-20130177501-A1 IN VIVO IMAGING METHOD OF MOOD DISORDERS SLC18A2, SLC6A2, SLC6A4 MEN1 832/4885KMT2A 573/4885PTPRC 2916/4885

“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.