SCHEMBL18178407

SCHEMBL18178407

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

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 8/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
NOTUM Q6P988 1/20 0.36
LMNA P02545 2/20 0.35
FFAR1 O14842 1/20 0.34
FFAR4 Q5NUL3 1/20 0.34
PTGER1 P34995 1/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
NPC1 O15118 1/20 0.34
ALDH1A1 P00352 1/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34
STAT3 P40763 1/20 0.34
STAT1 P42224 1/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
KDM4E B2RXH2 1/20 0.33
HPGD P15428 1/20 0.33
HSD17B10 Q99714 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
SCHEMBL18178213 0.93 MRGPRX4 (0.37) MRGPRX4L3MBTL1NOTUMFFAR1FFAR4
SCHEMBL18178312 0.92 MRGPRX4 (0.40) MRGPRX4L3MBTL1LMNANPC1ALDH1A1
SCHEMBL18182209 0.92 MRGPRX4 (0.36) MRGPRX4L3MBTL1NOTUMLMNAFFAR1
SCHEMBL18178411 0.90 MRGPRX4 (0.40) MRGPRX4L3MBTL1LMNAFFAR1FFAR4
SCHEMBL18178785 0.89 MRGPRX4 (0.36) MRGPRX4L3MBTL1FFAR1FFAR4PTGER1
SCHEMBL18178083 0.88 MRGPRX4 (0.42) MRGPRX4L3MBTL1NOTUMLMNAPTGER1
SCHEMBL18178412 0.88 MRGPRX4 (0.39) MRGPRX4PTGER1
SCHEMBL18178410 0.87 MRGPRX4 (0.43) MRGPRX4
SCHEMBL18178413 0.87 MRGPRX4 (0.39) MRGPRX4LMNAFFAR1FFAR4MEN1
SCHEMBL18178409 0.87 MRGPRX4 (0.39) MRGPRX4L3MBTL1LMNAFFAR1FFAR4

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 167/4885L3MBTL1 401/4885NOTUM 789/4885

“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.