SCHEMBL18178655

SCHEMBL18178655

CCC(=O)Oc1cccc(CC)c1COc1cc(Cl)c(C)cc1Cl

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 9/20 0.42
HTT P42858 2/20 0.37
ACHE P22303 1/20 0.37
TP53 P04637 1/20 0.37
PTGDR2 Q9Y5Y4 1/20 0.37
MAPT P10636 2/20 0.36
PTGER1 P34995 1/20 0.36
PTGER4 P35408 1/20 0.36
PTGER3 P43115 1/20 0.36
PTGER2 P43116 1/20 0.36
LMNA P02545 2/20 0.36
GAA P10253 2/20 0.36
KDM4E B2RXH2 1/20 0.36
GLA P06280 1/20 0.36
HPGD P15428 1/20 0.36
MAPK1 P28482 1/20 0.36
KMT2A Q03164 1/20 0.36
HSD17B10 Q99714 1/20 0.36
FFAR1 O14842 1/20 0.35
FFAR4 Q5NUL3 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
SCHEMBL18178721 0.94 MRGPRX4 (0.40) MRGPRX4HTTACHETP53PTGDR2
SCHEMBL18178691 0.93 MRGPRX4 (0.40) MRGPRX4HTTACHETP53PTGDR2
SCHEMBL18178672 0.93 MRGPRX4 (0.40) MRGPRX4HTTACHETP53PTGDR2
SCHEMBL18530978 0.93 MRGPRX4 (0.40) MRGPRX4HTTACHETP53PTGDR2
SCHEMBL18178688 0.92 MRGPRX4 (0.39) MRGPRX4HTTACHETP53PTGDR2
SCHEMBL18182041 0.91 MRGPRX4 (0.40) MRGPRX4HTTACHETP53PTGDR2
SCHEMBL18178651 0.91 SLC22A12 (0.41) MRGPRX4ACHEMAPTLMNAGAA
SCHEMBL18178650 0.91 MRGPRX4 (0.39) MRGPRX4ACHETP53MAPTPTGER1
SCHEMBL18156285 0.91 MRGPRX4 (0.43) MRGPRX4HTTTP53PTGER1PTGER4
SCHEMBL18178565 0.90 MRGPRX4 (0.40) MRGPRX4ACHEPTGDR2MAPTPTGER1

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 167/4885HTT 4153/4885ACHE 460/4885

“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.