SCHEMBL18178944

SCHEMBL18178944

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

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 5/20 0.43
RAB9A P51151 2/20 0.40
MAPT P10636 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
SLC22A12 Q96S37 1/20 0.39
PTGER1 P34995 2/20 0.37
PPARD Q03181 1/20 0.37
GUCY1B2 O75343 4/20 0.35
GUCY1A2 P33402 4/20 0.35
GUCY1A1 Q02108 4/20 0.35
GUCY1B1 Q02153 4/20 0.35
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
SCHEMBL18182083 0.91 MRGPRX4 (0.40) MRGPRX4MAPTNPSR1SLC22A12PTGER1
SCHEMBL18178948 0.88 SLC22A12 (0.47) MRGPRX4RAB9AMAPTNPSR1SLC22A12
SCHEMBL18178824 0.88 MRGPRX4 (0.47) MRGPRX4RAB9APTGER1PPARDFFAR4
SCHEMBL18178991 0.87 MRGPRX4 (0.44) MRGPRX4RAB9AMAPTNPSR1SLC22A12
SCHEMBL18178954 0.85 MAPT (0.40) MRGPRX4RAB9AMAPTNPSR1SLC22A12
SCHEMBL18178951 0.85 MAPT (0.40) MRGPRX4RAB9AMAPTNPSR1SLC22A12
SCHEMBL18178950 0.85 MAPT (0.40) MRGPRX4RAB9AMAPTNPSR1SLC22A12
SCHEMBL18178949 0.85 MAPT (0.40) MRGPRX4RAB9AMAPTNPSR1SLC22A12
SCHEMBL18178945 0.85 MRGPRX4 (0.40) MRGPRX4RAB9AMAPTNPSR1SLC22A12
SCHEMBL18178745 0.85 MRGPRX4 (0.43) MRGPRX4RAB9AMAPTNPSR1SLC22A12

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 167/4885RAB9A 1136/4885MAPT 4572/4885

“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.