SCHEMBL18181981

SCHEMBL18181981

CCc1cc(C(F)F)c(OCc2c(OC)cccc2OC(=O)OC)cc1Cl

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 4/20 0.39
FABP4 P15090 3/20 0.39
FABP5 Q01469 3/20 0.39
HDAC8 Q9BY41 2/20 0.37
FABP3 P05413 1/20 0.36
KCNK3 O14649 1/20 0.35
KCNK9 Q9NPC2 1/20 0.35
HTT P42858 2/20 0.35
LMNA P02545 1/20 0.35
HPGD P15428 2/20 0.34
KDM4E B2RXH2 1/20 0.34
HSD17B10 Q99714 1/20 0.34
ADRB2 P07550 1/20 0.34
TP53 P04637 1/20 0.34
HTR1A P08908 1/20 0.34
ADRA1D P25100 1/20 0.34
ADRA1A P35348 1/20 0.34
ADRA1B P35368 1/20 0.34

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
SCHEMBL18181995 0.94 MRGPRX4 (0.39) MRGPRX4FABP4FABP5FABP3KCNK3
SCHEMBL18182190 0.93 FABP4 (0.39) MRGPRX4FABP4FABP5FABP3HTT
SCHEMBL18182009 0.93 MRGPRX4 (0.39) MRGPRX4FABP4FABP5HDAC8FABP3
SCHEMBL18156421 0.92 MRGPRX4 (0.39) MRGPRX4FABP4FABP5HDAC8FABP3
SCHEMBL18182188 0.91 ALDH1A1 (0.40) MRGPRX4FABP4FABP5LMNA
SCHEMBL18156417 0.91 MRGPRX4 (0.36) MRGPRX4FABP4FABP5FABP3LMNA
SCHEMBL18182191 0.90 MRGPRX4 (0.36) MRGPRX4FABP4FABP5FABP3HTT
SCHEMBL18182193 0.90 MRGPRX4 (0.36) MRGPRX4FABP4FABP5HDAC8FABP3
SCHEMBL18182454 0.88 LMNA (0.37) KCNK3KCNK9HTTLMNAHPGD
SCHEMBL18182202 0.88 RECQL (0.35) MRGPRX4FABP4FABP5KCNK3KCNK9

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.