SCHEMBL18178449

SCHEMBL18178449

CCC(=O)Oc1cccc(CO)c1COc1ccc(C)cc1F

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 4/20 0.48
CD274 Q9NZQ7 1/20 0.36
LMNA P02545 2/20 0.35
MAPT P10636 1/20 0.35
GUCY1B2 O75343 4/20 0.35
GUCY1A2 P33402 4/20 0.35
GUCY1A1 Q02108 4/20 0.35
GUCY1B1 Q02153 4/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
ALDH1A1 P00352 2/20 0.35
MAPK1 P28482 2/20 0.35
PTGER1 P34995 2/20 0.35
PTGER4 P35408 2/20 0.35
PTGER3 P43115 2/20 0.35
PTGER2 P43116 2/20 0.35
FFAR1 O14842 2/20 0.35
KDM4E B2RXH2 2/20 0.34
KMT2A Q03164 2/20 0.34
GLA P06280 1/20 0.34
GAA P10253 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
SCHEMBL18178445 0.93 MRGPRX4 (0.50) MRGPRX4LMNAMAPTL3MBTL1ALDH1A1
SCHEMBL18178450 0.90 MRGPRX4 (0.47) MRGPRX4CD274LMNAMAPTL3MBTL1
SCHEMBL18178046 0.89 MRGPRX4 (0.48) MRGPRX4CD274LMNAMAPTGUCY1B2
SCHEMBL18178496 0.89 L3MBTL1 (0.41) MRGPRX4LMNAMAPTL3MBTL1ALDH1A1
SCHEMBL18178485 0.89 MRGPRX4 (0.46) MRGPRX4CD274LMNAMAPTL3MBTL1
SCHEMBL18178443 0.89 MRGPRX4 (0.52) MRGPRX4GUCY1B2GUCY1A2GUCY1A1GUCY1B1
SCHEMBL18178743 0.88 MRGPRX4 (0.37) MRGPRX4LMNAGUCY1B2GUCY1A2GUCY1A1
SCHEMBL18178444 0.87 MRGPRX4 (0.51) MRGPRX4LMNAMAPTL3MBTL1ALDH1A1
SCHEMBL18178506 0.87 KMT2A (0.35) MRGPRX4LMNAMAPTGUCY1B2GUCY1A2
SCHEMBL18178475 0.87 HPGD (0.43) CD274LMNAMAPTL3MBTL1ALDH1A1

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 167/4885CD274 3579/4885LMNA 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.