SCHEMBL18182602

SCHEMBL18182602

CCC(=O)Oc1ccccc1COc1cc(Cl)c(CC)cc1C(F)(F)F

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 10/20 0.45
TP53 P04637 1/20 0.41
HTT P42858 1/20 0.41
FFAR1 O14842 1/20 0.39
FFAR4 Q5NUL3 1/20 0.39
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
PTGDR2 Q9Y5Y4 1/20 0.38
SGMS2 Q8NHU3 1/20 0.37
MEN1 O00255 1/20 0.37
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
KMT2A Q03164 1/20 0.37
RXRA P19793 1/20 0.36
RXRB P28702 1/20 0.36
RXRG P48443 1/20 0.36
FABP4 P15090 2/20 0.36
FABP5 Q01469 2/20 0.36
NPC1 O15118 1/20 0.36

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
SCHEMBL18181973 0.90 MRGPRX4 (0.44) MRGPRX4TP53HTTFFAR1FFAR4
SCHEMBL18178678 0.90 FFAR4 (0.43) MRGPRX4TP53HTTFFAR1FFAR4
SCHEMBL18183067 0.89 MRGPRX4 (0.46) MRGPRX4TP53HTTMEN1ALDH1A1
SCHEMBL18156281 0.88 FFAR1 (0.40) MRGPRX4FFAR1FFAR4MAOAMAOB
SCHEMBL18182611 0.88 FFAR4 (0.44) MRGPRX4FFAR1FFAR4MAOAMAOB
SCHEMBL18183072 0.87 MRGPRX4 (0.45) MRGPRX4MEN1MAPTKMT2ARXRA
SCHEMBL18183066 0.87 MRGPRX4 (0.45) MRGPRX4MAPTFABP4FABP5FABP3
SCHEMBL18156142 0.87 MRGPRX4 (0.44) MRGPRX4FFAR1FFAR4RXRARXRB
SCHEMBL18182582 0.87 MRGPRX4 (0.44) MRGPRX4TP53HTTMAPTFABP4
SCHEMBL18156515 0.86 TP53 (0.46) MRGPRX4TP53HTTFFAR1FFAR4

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 167/4885TP53 4147/4885HTT 4153/4885

“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.