SCHEMBL18178424

SCHEMBL18178424

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

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 9/20 0.38
FFAR1 O14842 1/20 0.38
FFAR4 Q5NUL3 1/20 0.38
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
GUCY1B2 O75343 1/20 0.35
GUCY1A2 P33402 1/20 0.35
GUCY1A1 Q02108 1/20 0.35
GUCY1B1 Q02153 1/20 0.35
AAK1 Q2M2I8 1/20 0.34
NR1H2 P55055 1/20 0.34
NR1H3 Q13133 1/20 0.34
CTSA P10619 1/20 0.33
HPGD P15428 1/20 0.33
CD274 Q9NZQ7 1/20 0.33
KCNK3 O14649 1/20 0.33
KCNK9 Q9NPC2 1/20 0.33
RXRA P19793 1/20 0.33
RXRB P28702 1/20 0.33
RXRG P48443 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
SCHEMBL18178220 0.93 MRGPRX4 (0.37) MRGPRX4FFAR1FFAR4MEN1KMT2A
SCHEMBL18178413 0.93 MRGPRX4 (0.39) MRGPRX4FFAR1FFAR4MEN1KMT2A
SCHEMBL18178316 0.92 MRGPRX4 (0.41) MRGPRX4FFAR1FFAR4
SCHEMBL18178425 0.91 MRGPRX4 (0.37) MRGPRX4FFAR1FFAR4MEN1KMT2A
SCHEMBL18178789 0.89 FFAR1 (0.38) MRGPRX4FFAR1FFAR4MEN1KMT2A
SCHEMBL18178411 0.89 MRGPRX4 (0.40) MRGPRX4FFAR1FFAR4MEN1KMT2A
SCHEMBL18178084 0.88 MRGPRX4 (0.41) MRGPRX4FFAR1FFAR4AAK1HPGD
SCHEMBL18183043 0.87 MRGPRX4 (0.38) MRGPRX4FFAR1FFAR4MEN1KMT2A
SCHEMBL18178412 0.87 MRGPRX4 (0.39) MRGPRX4GUCY1B2GUCY1A2GUCY1A1GUCY1B1
SCHEMBL18178380 0.87 MAPT (0.42) MRGPRX4FFAR4HPGDCD274

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 167/4885FFAR1 2736/4885FFAR4 2485/4885

“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.