SCHEMBL417840

SCHEMBL417840

Fc1cccc(NCCOCc2ccccc2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
MAPT P10636 3/20 0.46
ALDH1A1 P00352 2/20 0.46
MAOB P27338 1/20 0.44
HPGD P15428 1/20 0.43
ICMT O60725 1/20 0.43
LRRK2 Q5S007 1/20 0.43
TSHR P16473 1/20 0.42
F2 P00734 1/20 0.42
CHRM3 P20309 2/20 0.42
HTT P42858 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
POLB P06746 1/20 0.41
SLC2A1 P11166 1/20 0.41
KDM4E B2RXH2 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
IDO1 P14902 1/20 0.41
AGXT P21549 1/20 0.41
MEN1 O00255 2/20 0.41

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
Hydrochloric Acid SCHEMBL10533792 0.85 LRRK2 (0.42) LMNAL3MBTL1MAPTALDH1A1MAOB
SCHEMBL414823 0.85 TSHR (0.54) LMNAL3MBTL1MAPTALDH1A1MAOB
SCHEMBL28941259 0.83 SMN1; SMN2 (0.43) LMNAL3MBTL1TSHRF2HTT
SCHEMBL419015 0.82 KCNH3 (0.47) LMNAL3MBTL1MAPTALDH1A1MAOB
SCHEMBL3903471 0.78 L3MBTL1 (0.66) LMNAL3MBTL1MAPTALDH1A1HPGD
SCHEMBL11015099 0.76 HPGD (0.63) LMNAL3MBTL1MAPTALDH1A1MAOB
SCHEMBL5105319 0.76 BCHE (0.57) LMNAL3MBTL1MAPTALDH1A1MAOB
SCHEMBL19347620 0.76 LMNA (0.47) LMNAL3MBTL1MAPTALDH1A1MAOB
SCHEMBL11675736 0.75 ALDH1A1 (0.57) LMNAL3MBTL1MAPTALDH1A1TSHR
SCHEMBL7221434 0.75 MEN1 (0.49) L3MBTL1MAPTALDH1A1HPGDICMT

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 18 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

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 LMNA 2612/4885L3MBTL1 4359/4885MAPT 2852/4885
US-20130183240-A1 IN VIVO IMAGING METHOD FOR CANCER MKI67, PBRM1, BRD4 LMNA 3416/4885L3MBTL1 2231/4885MAPT 4632/4885
US-20140364615-A1 INDOLE DERIVATIVES IDO1, IDO2, INMT LMNA 2612/4885L3MBTL1 4359/4885MAPT 2852/4885
US-20130177501-A1 IN VIVO IMAGING METHOD OF MOOD DISORDERS SLC18A2, SLC6A2, SLC6A4 LMNA 2390/4885L3MBTL1 3485/4885MAPT 1078/4885

“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.