SCHEMBL18178153

SCHEMBL18178153

COC(=O)Oc1cccc(C)c1COc1cc(F)c(C)cc1Br

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SLC22A12 Q96S37 1/20 0.39
PTGER1 P34995 2/20 0.38
MRGPRX4 Q96LA9 2/20 0.37
LMNA P02545 2/20 0.36
MAPT P10636 1/20 0.36
RAB9A P51151 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
PTPN1 P18031 1/20 0.36
SGMS2 Q8NHU3 1/20 0.35
MAPK14 Q16539 3/20 0.35
KDM4E B2RXH2 1/20 0.35
HPGD P15428 1/20 0.35
HSD17B10 Q99714 1/20 0.35
CUL4A Q13619 1/20 0.33
GUCY1B2 O75343 1/20 0.33
GUCY1A2 P33402 1/20 0.33
GUCY1A1 Q02108 1/20 0.33
GUCY1B1 Q02153 1/20 0.33
CD274 Q9NZQ7 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
SCHEMBL18178150 0.93 PTGER1 (0.40) PTGER1MRGPRX4MAPK14KDM4EHPGD
SCHEMBL18178151 0.93 MRGPRX4 (0.37) SLC22A12PTGER1MRGPRX4LMNAMAPT
SCHEMBL18178367 0.91 SLC22A12 (0.41) SLC22A12LMNAMAPTRAB9AL3MBTL1
SCHEMBL18178164 0.90 MAPT (0.36) PTGER1MRGPRX4LMNAMAPTL3MBTL1
SCHEMBL18178152 0.90 PTGER1 (0.38) PTGER1MRGPRX4LMNARAB9ASGMS2
SCHEMBL18178170 0.90 MRGPRX4 (0.35) SLC22A12PTGER1MRGPRX4LMNAMAPT
SCHEMBL18182935 0.90 PTGER1 (0.38) SLC22A12PTGER1MRGPRX4LMNAMAPT
SCHEMBL18178181 0.90 PTGER1 (0.36) PTGER1MRGPRX4MAPK14KDM4EHPGD
SCHEMBL18178125 0.90 MRGPRX4 (0.42) SLC22A12PTGER1MRGPRX4LMNAMAPT
SCHEMBL18178172 0.90 MRGPRX4 (0.44) SLC22A12PTGER1MRGPRX4LMNAMAPT

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 SLC22A12 4500/4885PTGER1 4234/4885MRGPRX4 167/4885

“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.