SCHEMBL18178788

SCHEMBL18178788

CCC(=O)Oc1cccc(CS)c1COc1cc(C)c(C)cc1C(F)(F)F

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.37
FFAR4 Q5NUL3 1/20 0.37
MRGPRX4 Q96LA9 10/20 0.36
ACHE P22303 1/20 0.34
KMT2A Q03164 2/20 0.33
KDM4E B2RXH2 2/20 0.33
HPGD P15428 2/20 0.33
HSD17B10 Q99714 2/20 0.33
MEN1 O00255 1/20 0.33
LMNA P02545 1/20 0.33
GLA P06280 1/20 0.33
GAA P10253 1/20 0.33
MAPK1 P28482 1/20 0.33
KCNK3 O14649 1/20 0.32
KCNK9 Q9NPC2 1/20 0.32
RXRA P19793 1/20 0.32
RXRB P28702 1/20 0.32
RXRG P48443 1/20 0.32
ALDH1A1 P00352 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32

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
SCHEMBL18178618 0.93 MRGPRX4 (0.37) FFAR1FFAR4MRGPRX4ACHEKMT2A
SCHEMBL18178790 0.93 FFAR1 (0.39) FFAR1FFAR4MRGPRX4ACHEKMT2A
SCHEMBL18178711 0.92 MRGPRX4 (0.41) FFAR1FFAR4MRGPRX4
SCHEMBL18178789 0.91 FFAR1 (0.38) FFAR1FFAR4MRGPRX4ACHEKMT2A
SCHEMBL18178425 0.90 MRGPRX4 (0.37) FFAR1FFAR4MRGPRX4KMT2AKDM4E
SCHEMBL18178516 0.89 MRGPRX4 (0.39) FFAR1FFAR4MRGPRX4HPGDRXRA
SCHEMBL18178786 0.88 SLC22A12 (0.39) FFAR1FFAR4MRGPRX4ACHEKMT2A
SCHEMBL18183087 0.87 FFAR1 (0.39) FFAR1FFAR4MRGPRX4ACHEKMT2A
SCHEMBL18178756 0.87 NPSR1 (0.39) FFAR4MRGPRX4ACHEKMT2AKDM4E
SCHEMBL18178784 0.86 MRGPRX4 (0.39) MRGPRX4

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 FFAR1 2736/4885FFAR4 2485/4885MRGPRX4 167/4885

“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.