SCHEMBL18178316

SCHEMBL18178316

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

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 10/20 0.41
RORC P51449 5/20 0.36
FFAR1 O14842 1/20 0.36
FFAR4 Q5NUL3 1/20 0.36
TRPV1 Q8NER1 1/20 0.35
LMNA P02545 2/20 0.35
ALDH1A1 P00352 1/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35
HTT P42858 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL18178315 0.93 MRGPRX4 (0.44) MRGPRX4RORCFFAR1FFAR4LMNA
SCHEMBL18178424 0.92 MRGPRX4 (0.38) MRGPRX4FFAR1FFAR4
SCHEMBL18178318 0.91 MRGPRX4 (0.40) MRGPRX4RORCFFAR1FFAR4LMNA
SCHEMBL18178664 0.90 MRGPRX4 (0.41) MRGPRX4RORCFFAR1FFAR4
SCHEMBL18178314 0.90 MRGPRX4 (0.42) MRGPRX4RORCTRPV1LMNAALDH1A1
SCHEMBL18178309 0.90 MRGPRX4 (0.42) MRGPRX4RORCLMNAALDH1A1SMN1; SMN2
SCHEMBL18178220 0.89 MRGPRX4 (0.37) MRGPRX4FFAR1FFAR4
SCHEMBL18178308 0.88 MRGPRX4 (0.41) MRGPRX4LMNASMN1; SMN2
SCHEMBL18178280 0.88 LMNA (0.38) MRGPRX4FFAR1FFAR4LMNAALDH1A1
SCHEMBL18178259 0.88 MRGPRX4 (0.40) MRGPRX4LMNAALDH1A1GAAMAPT

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 167/4885RORC 1507/4885FFAR1 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.