SCHEMBL18181995

SCHEMBL18181995

CCOc1cccc(OC(=O)OC)c1COc1cc(Cl)c(CC)cc1C(F)F

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 5/20 0.39
FABP4 P15090 2/20 0.39
FABP5 Q01469 2/20 0.39
FABP3 P05413 1/20 0.36
ALDH1A1 P00352 3/20 0.36
POLB P06746 1/20 0.36
KMT2A Q03164 3/20 0.36
LMNA P02545 2/20 0.36
MEN1 O00255 2/20 0.36
KDM4E B2RXH2 2/20 0.36
MAPT P10636 2/20 0.36
HTT P42858 2/20 0.36
GAA P10253 1/20 0.36
THRB P10828 1/20 0.36
XBP1 P17861 1/20 0.36
ALOX12 P18054 1/20 0.36
BLM P54132 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
RORC P51449 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
SCHEMBL18181981 0.94 MRGPRX4 (0.39) MRGPRX4FABP4FABP5FABP3LMNA
SCHEMBL18182009 0.93 MRGPRX4 (0.39) MRGPRX4FABP4FABP5FABP3ALDH1A1
SCHEMBL18182190 0.93 FABP4 (0.39) MRGPRX4FABP4FABP5FABP3ALDH1A1
SCHEMBL18156417 0.91 MRGPRX4 (0.36) MRGPRX4FABP4FABP5FABP3LMNA
SCHEMBL18182188 0.91 ALDH1A1 (0.40) MRGPRX4FABP4FABP5ALDH1A1POLB
SCHEMBL18183068 0.91 MRGPRX4 (0.39) MRGPRX4FABP4FABP5FABP3ALDH1A1
SCHEMBL18182191 0.90 MRGPRX4 (0.36) MRGPRX4FABP4FABP5FABP3ALDH1A1
SCHEMBL18182193 0.90 MRGPRX4 (0.36) MRGPRX4FABP4FABP5FABP3ALDH1A1
SCHEMBL18178304 0.90 LMNA (0.39) MRGPRX4FABP4FABP5ALDH1A1POLB
SCHEMBL18182375 0.89 FABP4 (0.41) MRGPRX4FABP4FABP5FABP3ALDH1A1

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 167/4885FABP4 4134/4885FABP5 3786/4885

“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.