SCHEMBL18178396

SCHEMBL18178396

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

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GUCY1B2 O75343 12/20 0.37
GUCY1A2 P33402 12/20 0.37
GUCY1A1 Q02108 12/20 0.37
GUCY1B1 Q02153 12/20 0.37
PTGER1 P34995 1/20 0.36
MRGPRX4 Q96LA9 3/20 0.35
PPARD Q03181 1/20 0.35
KDM4E B2RXH2 1/20 0.35
HPGD P15428 1/20 0.35
HSD17B10 Q99714 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
SCHEMBL18178196 0.94 MRGPRX4 (0.37) GUCY1B2GUCY1A2GUCY1A1GUCY1B1PTGER1
SCHEMBL18178297 0.91 SGMS2 (0.39) PPARDKDM4E
SCHEMBL18182974 0.91 PTGER1 (0.36) GUCY1B2GUCY1A2GUCY1A1GUCY1B1PTGER1
SCHEMBL18178397 0.91 SLC22A12 (0.40) MRGPRX4KDM4EHPGDHSD17B10
SCHEMBL18178773 0.89 GUCY1B2 (0.37) GUCY1B2GUCY1A2GUCY1A1GUCY1B1MRGPRX4
SCHEMBL18178403 0.89 MRGPRX4 (0.37) MRGPRX4KDM4EHPGDHSD17B10
SCHEMBL18178343 0.88 MRGPRX4 (0.40) GUCY1B2GUCY1A2GUCY1A1GUCY1B1PTGER1
SCHEMBL18178381 0.88 MRGPRX4 (0.43) GUCY1B2GUCY1A2GUCY1A1GUCY1B1PTGER1
SCHEMBL18178200 0.88 SLC22A12 (0.38) GUCY1B2GUCY1A2GUCY1A1GUCY1B1PTGER1
SCHEMBL18178400 0.88 FABP4 (0.38) PTGER1MRGPRX4KDM4EHPGDHSD17B10

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 GUCY1B2 3488/4885GUCY1A2 3249/4885GUCY1A1 3519/4885

“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.