SCHEMBL18156513

SCHEMBL18156513

CCC(=S)Oc1cccc(CC)c1COc1cc(C)c(CC)cc1C

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SLC22A12 Q96S37 1/20 0.36
PTGDR2 Q9Y5Y4 2/20 0.33
HTT P42858 1/20 0.32
RECQL P46063 1/20 0.32
MRGPRX4 Q96LA9 7/20 0.32
MAPT P10636 1/20 0.32
RAB9A P51151 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
FFAR4 Q5NUL3 3/20 0.31
RXRA P19793 1/20 0.31
RXRB P28702 1/20 0.31
ALDH1A1 P00352 1/20 0.30
FFAR1 O14842 1/20 0.30
SLC6A2 P23975 1/20 0.30
SLC6A4 P31645 1/20 0.30
SLC6A3 Q01959 1/20 0.30
CD274 Q9NZQ7 1/20 0.30

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
SCHEMBL18179041 0.94 MAPT (0.38) SLC22A12PTGDR2MRGPRX4MAPTRAB9A
SCHEMBL18182661 0.93 SLC22A12 (0.41) SLC22A12PTGDR2HTTRECQLMRGPRX4
SCHEMBL18182664 0.91 L3MBTL1 (0.35) SLC22A12PTGDR2RECQLMRGPRX4MAPT
SCHEMBL18182680 0.91 MRGPRX4 (0.35) SLC22A12PTGDR2HTTRECQLMRGPRX4
SCHEMBL18182673 0.90 FFAR4 (0.35) SLC22A12HTTRECQLMRGPRX4MAPT
SCHEMBL18182638 0.90 PTGER1 (0.35) SLC22A12PTGDR2HTTRECQLMRGPRX4
SCHEMBL18182621 0.90 MRGPRX4 (0.37) SLC22A12HTTMRGPRX4MAPTRAB9A
SCHEMBL18182668 0.90 SLC22A12 (0.34) SLC22A12HTTRECQLMRGPRX4MAPT
SCHEMBL18182903 0.89 SLC22A12 (0.36) SLC22A12PTGDR2HTTRECQLMRGPRX4
SCHEMBL18156388 0.88 SLC22A12 (0.36) SLC22A12PTGDR2HTTRECQLMRGPRX4

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 3 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
EP-3081559-A1 AROMATIC COMPOUND AND APPLICATION FOR SAME Sumitomo Chemical Company, Limited (JP) 2016-10-19 EP 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 SLC22A12 4500/4885PTGDR2 4455/4885HTT 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.