SCHEMBL18178151

SCHEMBL18178151

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

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 2/20 0.37
PTGER1 P34995 1/20 0.36
LMNA P02545 3/20 0.35
MAPT P10636 3/20 0.35
RAB9A P51151 2/20 0.35
MEN1 O00255 1/20 0.35
NPC1 O15118 1/20 0.35
ALDH1A1 P00352 1/20 0.35
GAA P10253 1/20 0.35
STAT3 P40763 1/20 0.35
STAT1 P42224 1/20 0.35
KMT2A Q03164 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
MAPK14 Q16539 2/20 0.35
KDM4E B2RXH2 1/20 0.35
HPGD P15428 1/20 0.35
HSD17B10 Q99714 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
SLC22A12 Q96S37 1/20 0.34
CUL4A Q13619 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
SCHEMBL18178137 0.93 MRGPRX4 (0.40) MRGPRX4PTGER1LMNAMAPTRAB9A
SCHEMBL18178176 0.93 MRGPRX4 (0.42) MRGPRX4PTGER1LMNAMAPTRAB9A
SCHEMBL18178153 0.93 SLC22A12 (0.39) MRGPRX4PTGER1LMNAMAPTRAB9A
SCHEMBL18178150 0.93 PTGER1 (0.40) MRGPRX4PTGER1MAPK14KDM4EHPGD
SCHEMBL18178366 0.91 CUL4A (0.38) MRGPRX4LMNAMAPTRAB9AMEN1
SCHEMBL18178152 0.90 PTGER1 (0.38) MRGPRX4PTGER1LMNARAB9AALDH1A1
SCHEMBL18178181 0.90 PTGER1 (0.36) MRGPRX4PTGER1MEN1ALDH1A1KMT2A
SCHEMBL18178170 0.90 MRGPRX4 (0.35) MRGPRX4PTGER1LMNAMAPTRAB9A
SCHEMBL18178164 0.90 MAPT (0.36) MRGPRX4PTGER1LMNAMAPTMEN1
SCHEMBL18178148 0.90 MRGPRX4 (0.35) MRGPRX4PTGER1LMNAMAPTMEN1

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 MRGPRX4 167/4885PTGER1 4234/4885LMNA 4171/4885

“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.