SCHEMBL18178472

SCHEMBL18178472

CCC(=O)Oc1cccc(Br)c1COc1ccc(C)cc1C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 2/20 0.47
FFAR4 Q5NUL3 3/20 0.42
L3MBTL1 Q9Y468 4/20 0.41
NPC1 O15118 3/20 0.41
RAB9A P51151 3/20 0.41
MAPT P10636 3/20 0.41
ALDH1A1 P00352 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
HPGD P15428 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
NPSR1 Q6W5P4 1/20 0.41
TP53 P04637 1/20 0.39
HSD17B10 Q99714 1/20 0.39
ABL1 P00519 1/20 0.39
RIN1 Q13671 1/20 0.39
POLB P06746 1/20 0.38
ACHE P22303 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
HSP90AA1 P07900 1/20 0.37

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
SCHEMBL18178468 0.92 TDP1 (0.46) L3MBTL1NPC1RAB9AMAPTALDH1A1
SCHEMBL18178491 0.89 FFAR4 (0.39) MRGPRX4FFAR4L3MBTL1NPC1RAB9A
SCHEMBL18178473 0.89 MRGPRX4 (0.50) MRGPRX4FFAR4L3MBTL1NPC1RAB9A
SCHEMBL18178447 0.88 MRGPRX4 (0.49) MRGPRX4L3MBTL1NPC1RAB9AMAPT
SCHEMBL18178456 0.88 MRGPRX4 (0.49) MRGPRX4L3MBTL1NPC1RAB9AMAPT
SCHEMBL18156399 0.88 FFAR4 (0.47) MRGPRX4FFAR4MAPT
SCHEMBL18178159 0.88 MRGPRX4 (0.47) MRGPRX4FFAR4L3MBTL1NPC1RAB9A
SCHEMBL18178754 0.88 MAPT (0.40) MRGPRX4FFAR4NPC1RAB9AMAPT
SCHEMBL18178871 0.88 MRGPRX4 (0.49) MRGPRX4FFAR4L3MBTL1NPC1RAB9A
SCHEMBL18178478 0.87 MRGPRX4 (0.48) MRGPRX4FFAR4L3MBTL1NPC1RAB9A

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 167/4885FFAR4 2485/4885L3MBTL1 401/4885

“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.