SCHEMBL17065792

SCHEMBL17065792

C=CCc1c[nH]c2cc(Br)cc(C(=O)OC)c12

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 9/20 0.44
MTNR1A P48039 3/20 0.36
MTNR1B P49286 3/20 0.36
CREBBP Q92793 1/20 0.36
NPC1 O15118 1/20 0.36
GPR84 Q9NQS5 1/20 0.34
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
MAPT P10636 1/20 0.34
HPGD P15428 1/20 0.34
HTT P42858 1/20 0.34
HSD17B10 Q99714 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
CDK2 P24941 2/20 0.33
CHEK1 O14757 1/20 0.33

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
SCHEMBL17065786 0.85 NR4A2 (0.47) NR4A2MTNR1AMTNR1BCREBBPNPC1
SCHEMBL703667 0.80 NR4A2 (0.52) NR4A2MTNR1AMTNR1BCREBBPGPR84
SCHEMBL20111796 0.77 NR4A2 (0.51) NR4A2CREBBPKDM4EALDH1A1MAPT
SCHEMBL24330121 0.76 NR4A2 (0.48) NR4A2CREBBPKDM4EALDH1A1MAPT
SCHEMBL3935495 0.76 KDM4E (0.39) NR4A2KDM4EALDH1A1MAPTHPGD
SCHEMBL7867138 0.74 NR4A2 (0.44) NR4A2KDM4EALDH1A1LMNAMAPT
SCHEMBL3934618 0.73 SMN1; SMN2 (0.39) NPC1KDM4EALDH1A1LMNAMAPT
SCHEMBL23305035 0.73 NR4A2 (0.47) NR4A2CREBBPKDM4EALDH1A1LMNA
SCHEMBL17065790 0.71 KRAS (0.32) ALDH1A1HPGD
SCHEMBL28902320 0.71 PTPRA (0.47) NR4A2NPC1GPR84MAPTCDK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170015666-A1 ENHANCER OF ZESTE HOMOLOG 2 INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2017-01-19 US disclosed
US-20170015666-A1 ENHANCER OF ZESTE HOMOLOG 2 INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2017-01-19 US disclosed
EP-3114125-A1 ENHANCER OF ZESTE HOMOLOG 2 INHIBITORS Glaxosmithkline Intellectual Property (No. 2) Limited (GB) 2017-01-11 EP disclosed
WO-2015132765-A1 ENHANCER OF ZESTE HOMOLOG 2 INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2015-09-11 WO disclosed
WO-2015132765-A1 ENHANCER OF ZESTE HOMOLOG 2 INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2015-09-11 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 (1 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-20170015666-A1 ENHANCER OF ZESTE HOMOLOG 2 INHIBITORS EZH2, BMI1, EZH1 NR4A2 722/4885MTNR1A 3005/4885MTNR1B 3437/4885

“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.