SCHEMBL18178079

SCHEMBL18178079

CCc1cc(C)ccc1OCc1c(I)cccc1OC(=O)OC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.40
L3MBTL1 Q9Y468 3/20 0.40
PTGER1 P34995 2/20 0.39
PTGER4 P35408 2/20 0.39
PTGER3 P43115 2/20 0.39
PTGER2 P43116 2/20 0.39
MRGPRX4 Q96LA9 3/20 0.36
PTGS2 P35354 1/20 0.35
HPGD P15428 2/20 0.35
HSD17B10 Q99714 1/20 0.35
MAPT P10636 2/20 0.34
NPSR1 Q6W5P4 2/20 0.34
HSP90AA1 P07900 1/20 0.34
HTT P42858 1/20 0.34
MAPK1 P28482 1/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
KCNMA1 Q12791 1/20 0.34

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
SCHEMBL18178490 0.90 KDM4E (0.38) KDM4EL3MBTL1PTGER1PTGER4PTGER3
SCHEMBL18178168 0.90 KDM4E (0.45) KDM4EL3MBTL1PTGER1PTGER4PTGER3
SCHEMBL18182154 0.89 MAPT (0.36) KDM4EL3MBTL1HPGDHSD17B10MAPT
SCHEMBL18178070 0.88 MRGPRX4 (0.47) KDM4EL3MBTL1MRGPRX4HPGDHSD17B10
SCHEMBL18178080 0.88 L3MBTL1 (0.41) KDM4EL3MBTL1PTGER1PTGER4PTGER3
SCHEMBL18178389 0.87 KDM4E (0.35) KDM4EL3MBTL1HPGDHSD17B10MAPT
SCHEMBL18178109 0.87 L3MBTL1 (0.41) KDM4EL3MBTL1PTGER1PTGER4PTGER3
SCHEMBL18178124 0.86 PTGER1 (0.42) KDM4EL3MBTL1PTGER1PTGER4PTGER3
SCHEMBL18178107 0.86 KDM4E (0.43) KDM4EL3MBTL1PTGER1PTGER4PTGER3
SCHEMBL18178119 0.86 MRGPRX4 (0.49) KDM4EL3MBTL1PTGER1PTGER4PTGER3

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-9573904-B2 Aromatic compound and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-02-21 US disclosed
US-20160311775-A1 AROMATIC COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-10-27 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 (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-20160311775-A1 AROMATIC COMPOUND AND USE THEREOF ZCCHC8, CBR3, CBX8 KDM4E 2107/4885L3MBTL1 401/4885PTGER1 4234/4885

“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.