SCHEMBL18156142

SCHEMBL18156142

CCC(=O)Oc1cccc(C(F)(F)F)c1COc1cc(Cl)c(CC)cc1C(F)(F)F

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 14/20 0.44
KCNK3 O14649 1/20 0.37
KCNK9 Q9NPC2 1/20 0.37
RXRA P19793 1/20 0.35
RXRB P28702 1/20 0.35
RXRG P48443 1/20 0.35
FABP3 P05413 1/20 0.35
FABP4 P15090 1/20 0.35
FABP5 Q01469 1/20 0.35
CTSS P25774 1/20 0.34
CTSK P43235 1/20 0.34
FFAR1 O14842 1/20 0.34
FFAR4 Q5NUL3 1/20 0.34
FGFR4 P22455 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
SCHEMBL18183054 0.94 MRGPRX4 (0.46) MRGPRX4KCNK3KCNK9RXRARXRB
SCHEMBL18183065 0.94 MRGPRX4 (0.44) MRGPRX4KCNK3KCNK9RXRARXRB
SCHEMBL18182582 0.94 MRGPRX4 (0.44) MRGPRX4KCNK3KCNK9FABP3FABP4
SCHEMBL18183067 0.94 MRGPRX4 (0.46) MRGPRX4KCNK3KCNK9FABP3FABP4
SCHEMBL18182580 0.92 MRGPRX4 (0.42) MRGPRX4
SCHEMBL18183072 0.92 MRGPRX4 (0.45) MRGPRX4KCNK3KCNK9RXRARXRB
SCHEMBL18182581 0.92 MRGPRX4 (0.42) MRGPRX4KCNK3KCNK9FABP3FABP4
SCHEMBL18183066 0.92 MRGPRX4 (0.45) MRGPRX4FABP3FABP4FABP5FGFR4
SCHEMBL18532847 0.92 MRGPRX4 (0.42) MRGPRX4KCNK3KCNK9FFAR1FFAR4
SCHEMBL18183034 0.92 MRGPRX4 (0.42) MRGPRX4KCNK3KCNK9RXRARXRB

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 3 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
EP-3081559-A1 AROMATIC COMPOUND AND APPLICATION FOR SAME Sumitomo Chemical Company, Limited (JP) 2016-10-19 EP 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 167/4885KCNK3 463/4885KCNK9 626/4885

“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.