SCHEMBL9948832

SCHEMBL9948832

CCCCCCCCCCCCCCCc1csc2c(Br)c(C(=O)CCCCCCCCCCCCCC)sc12

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GPR35 Q9HC97 6/20 0.49
CA2 P00918 1/20 0.41
ELANE P08246 3/20 0.40
PLA2G4A P47712 1/20 0.39
CYSLTR2 Q9NS75 2/20 0.37
CYSLTR1 Q9Y271 2/20 0.37
HSD17B3 P37058 4/20 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
SCHEMBL10018136 1.00 GPR35 (0.49) GPR35CA2ELANEPLA2G4ACYSLTR2
SCHEMBL10144491 0.86 GPR35 (0.57) GPR35CA2ELANEPLA2G4AHSD17B3
SCHEMBL1156737 0.83 CA2 (0.45) GPR35CA2PLA2G4AHSD17B3
SCHEMBL1363701 0.83 CES2 (0.47) GPR35PLA2G4AHSD17B3
SCHEMBL1365090 0.83 CES2 (0.47) GPR35PLA2G4AHSD17B3
SCHEMBL1364678 0.83 CES2 (0.47) GPR35PLA2G4AHSD17B3
SCHEMBL14647663 0.79 GPR35 (0.46) GPR35CYSLTR2CYSLTR1
SCHEMBL14647690 0.79 GPR35 (0.46) GPR35CYSLTR2CYSLTR1
SCHEMBL1156975 0.75 GPR35 (0.53) GPR35CYSLTR2CYSLTR1
SCHEMBL1156982 0.75 GPR35 (0.53) GPR35CYSLTR2CYSLTR1

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-9166167-B2 P-type materials and organic electronic devices AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2015-10-20 US disclosed
US-20120161117-A1 P-TYPE MATERIALS AND ORGANIC ELECTRONIC DEVICES AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2012-06-28 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-20120161117-A1 P-TYPE MATERIALS AND ORGANIC ELECTRONIC DEVICES POP1, CACNA1A, PNN GPR35 4807/4885CA2 3234/4885ELANE 2740/4885

“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.