SCHEMBL10111236

SCHEMBL10111236

CCCCCCCCC1(CCCCCCCC)c2cc(C)ccc2-c2ccc(-c3ccc4c(c3)C(CCCOC=O)(CCCC(=O)O)c3cc(C)ccc3-4)cc21

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.36
PTPN11 Q06124 7/20 0.35
LTB4R Q15722 1/20 0.34
FFAR4 Q5NUL3 1/20 0.34
S1PR5 Q9H228 2/20 0.33
FABP4 P15090 1/20 0.32
CNR1 P21554 1/20 0.32
CNR2 P34972 1/20 0.32
PTPN1 P18031 1/20 0.32
PTPN6 P29350 1/20 0.32
PLA2G4B P0C869 2/20 0.31
GAA P10253 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
RARB P10826 1/20 0.31

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
SCHEMBL19101541 0.90 GPR84 (0.38) TSHRPTPN11FFAR4FABP4CNR1
SCHEMBL10111022 0.88 GPR84 (0.36) TSHRPTPN11FFAR4FABP4CNR1
SCHEMBL12924928 0.83 APEX1 (0.42) TSHRPTPN11FFAR4FABP4CNR1
SCHEMBL10111020 0.83 GPR84 (0.46) TSHRFFAR4FABP4PTPN1TDP1
SCHEMBL25627289 0.82 RARB (0.43) TSHRPTPN11PLA2G4BRARB
SCHEMBL15341580 0.80 HRH3 (0.32) PTPN11GAA
SCHEMBL18357046 0.79 RARB (0.45) PTPN11FFAR4PLA2G4BRARB
SCHEMBL12924927 0.79 MEN1 (0.40) PTPN11CNR1RARB
SCHEMBL15341578 0.78 THRA (0.33) FFAR4RARB
SCHEMBL15341582 0.78 TSHR (0.34) TSHRGAATDP1

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-9536633-B2 Metallic composite and composition thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-01-03 US disclosed
US-20120032121-A1 METALLIC COMPOSITE AND COMPOSITION THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-02-09 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-20120032121-A1 METALLIC COMPOSITE AND COMPOSITION THEREOF CDH1, EPCAM, CD4 TSHR 3714/4885PTPN11 1694/4885LTB4R 1589/4885

“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.