SCHEMBL18182437

SCHEMBL18182437

CCC(=O)Oc1cccc(C)c1COc1cc(F)c(CC)cc1C(F)(F)F

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 8/20 0.38
SLC22A12 Q96S37 1/20 0.36
FFAR1 O14842 1/20 0.35
FFAR4 Q5NUL3 1/20 0.35
ACHE P22303 1/20 0.34
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
HPGD P15428 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
HSD17B10 Q99714 1/20 0.34
GUCY1B2 O75343 2/20 0.33
GUCY1A2 P33402 2/20 0.33
GUCY1A1 Q02108 2/20 0.33
GUCY1B1 Q02153 2/20 0.33
PPARD Q03181 1/20 0.33
PTGER1 P34995 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
SCHEMBL18182433 0.92 MRGPRX4 (0.39) MRGPRX4GUCY1B2GUCY1A2GUCY1A1GUCY1B1
SCHEMBL18181990 0.92 MRGPRX4 (0.39) MRGPRX4FFAR1FFAR4GUCY1B2GUCY1A2
SCHEMBL18182024 0.92 MRGPRX4 (0.39) MRGPRX4FFAR1FFAR4
SCHEMBL18178602 0.92 MRGPRX4 (0.39) MRGPRX4SLC22A12FFAR1FFAR4ACHE
SCHEMBL18182585 0.92 SLC22A12 (0.37) MRGPRX4SLC22A12FFAR1FFAR4ACHE
SCHEMBL18182762 0.91 MRGPRX4 (0.37) MRGPRX4SLC22A12FFAR1FFAR4ALDH1A1
SCHEMBL18182030 0.90 KCNK3 (0.39) MRGPRX4FFAR1ALDH1A1
SCHEMBL18182003 0.90 MRGPRX4 (0.38) MRGPRX4ALDH1A1
SCHEMBL18182435 0.90 MRGPRX4 (0.41) MRGPRX4ALDH1A1
SCHEMBL18182581 0.89 MRGPRX4 (0.42) MRGPRX4SLC22A12FFAR1FFAR4ACHE

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 4500/4885FFAR1 2736/4885

“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.