SCHEMBL18178302

SCHEMBL18178302

CCc1cccc(OC(=O)OC)c1COc1cc(Cl)c(C)cc1C(F)F

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 6/20 0.38
FABP4 P15090 2/20 0.38
FABP5 Q01469 2/20 0.38
LMNA P02545 3/20 0.36
ALDH1A1 P00352 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
NPSR1 Q6W5P4 2/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
HTT P42858 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
KDM4E B2RXH2 2/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
HPGD P15428 1/20 0.34
HSD17B10 Q99714 1/20 0.34
AKR1C3 P42330 2/20 0.34
PTGDR2 Q9Y5Y4 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
SCHEMBL18178307 0.93 FABP4 (0.37) MRGPRX4FABP4FABP5LMNAALDH1A1
SCHEMBL18178306 0.92 FABP4 (0.37) MRGPRX4FABP4FABP5LMNAALDH1A1
SCHEMBL18182009 0.92 MRGPRX4 (0.39) MRGPRX4FABP4FABP5ALDH1A1SMN1; SMN2
SCHEMBL18178402 0.92 KDM4E (0.34) MRGPRX4FABP4FABP5LMNANPSR1
SCHEMBL18178304 0.91 LMNA (0.39) MRGPRX4FABP4FABP5LMNAALDH1A1
SCHEMBL18178674 0.91 MRGPRX4 (0.39) MRGPRX4FABP4FABP5LMNAALDH1A1
SCHEMBL18178303 0.91 LMNA (0.38) MRGPRX4FABP4FABP5LMNAALDH1A1
SCHEMBL18178305 0.91 LMNA (0.38) MRGPRX4FABP4FABP5LMNAALDH1A1
SCHEMBL18178297 0.89 SGMS2 (0.39) LMNAALDH1A1SMN1; SMN2NPSR1GAA
SCHEMBL18178210 0.89 MRGPRX4 (0.35) MRGPRX4FABP4FABP5LMNAALDH1A1

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 167/4885FABP4 4134/4885FABP5 3786/4885

“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.