SCHEMBL18178172

SCHEMBL18178172

COC(=O)Oc1cccc(C)c1COc1cc(F)c(C)cc1C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 2/20 0.44
SLC22A12 Q96S37 1/20 0.43
LMNA P02545 2/20 0.38
MAPT P10636 2/20 0.38
RAB9A P51151 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
PTPN1 P18031 1/20 0.38
SGMS2 Q8NHU3 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
KDM4E B2RXH2 1/20 0.37
HPGD P15428 1/20 0.37
HSD17B10 Q99714 1/20 0.37
PPARA Q07869 2/20 0.35
PTGER1 P34995 1/20 0.35
GUCY1B2 O75343 1/20 0.35
GUCY1A2 P33402 1/20 0.35
GUCY1A1 Q02108 1/20 0.35
GUCY1B1 Q02153 1/20 0.35
FFAR1 O14842 1/20 0.34
FFAR4 Q5NUL3 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
SCHEMBL18178175 0.93 MRGPRX4 (0.44) MRGPRX4SLC22A12LMNAMAPTRAB9A
SCHEMBL18178125 0.93 MRGPRX4 (0.42) MRGPRX4SLC22A12LMNAMAPTRAB9A
SCHEMBL18178379 0.90 SLC22A12 (0.47) MRGPRX4SLC22A12LMNAMAPTRAB9A
SCHEMBL18178153 0.90 SLC22A12 (0.39) MRGPRX4SLC22A12LMNAMAPTRAB9A
SCHEMBL18178135 0.90 SLC22A12 (0.39) MRGPRX4SLC22A12LMNAMAPTRAB9A
SCHEMBL18178185 0.90 SLC22A12 (0.39) MRGPRX4SLC22A12LMNAMAPTRAB9A
SCHEMBL18178178 0.90 MRGPRX4 (0.42) MRGPRX4SLC22A12LMNAMAPTRAB9A
SCHEMBL18182942 0.90 MRGPRX4 (0.42) MRGPRX4SLC22A12LMNAMAPTRAB9A
SCHEMBL18178176 0.90 MRGPRX4 (0.42) MRGPRX4SLC22A12LMNAMAPTRAB9A
SCHEMBL18178179 0.90 MRGPRX4 (0.42) MRGPRX4LMNARAB9ASGMS2PTGER1

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 167/4885SLC22A12 4500/4885LMNA 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.