SCHEMBL2763074

SCHEMBL2763074

O=S(=O)(O)COn1c2ccccc2c2ccccc21

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.39
CYP1A2 P05177 1/20 0.38
CYP2C19 P33261 1/20 0.38
POLB P06746 2/20 0.37
FABP4 P15090 4/20 0.37
FABP5 Q01469 4/20 0.37
FABP3 P05413 2/20 0.37
BACE1 P56817 2/20 0.36
PER2 O15055 2/20 0.36
CRY1 Q16526 2/20 0.36
CRY2 Q49AN0 2/20 0.36
ALDH1A1 P00352 1/20 0.35
GPR3 P46089 1/20 0.34
HTR6 P50406 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 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
SCHEMBL27772278 0.70 LMNA (0.50) KDM4ECYP1A2CYP2C19POLBALDH1A1
SCHEMBL6533272 0.69 CYP1A2 (0.40) KDM4ECYP1A2CYP2C19POLBFABP4
SCHEMBL9608608 0.68 FABP4 (0.44) KDM4ECYP1A2CYP2C19POLBFABP4
SCHEMBL9908935 0.68 POLB (0.47) KDM4EPOLBFABP4FABP5FABP3
SCHEMBL28018005 0.67 FABP4 (0.50) KDM4ECYP1A2CYP2C19POLBFABP4
SCHEMBL28824473 0.67 GPR3 (0.43) KDM4ECYP1A2CYP2C19POLBALDH1A1
Ethane SCHEMBL28213584 0.67 PER2 (0.49) KDM4EPOLBBACE1PER2CRY1
SCHEMBL19583449 0.66 GPR3 (0.46) KDM4ECYP1A2CYP2C19POLBFABP4
SCHEMBL17224372 0.66 FABP4 (0.57) KDM4EFABP4FABP5FABP3HDAC6
SCHEMBL17394563 0.65 GPR3 (0.50) KDM4ECYP1A2CYP2C19POLBFABP4

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2221347-A1 Sulfonated diarylrhodamine dyes Applera Corporation (US) 2010-08-25 EP disclosed
EP-2179996-A1 Sulfonated diarylrhodamine dyes Applera Corporation (US) 2010-04-28 EP disclosed
US-7018431-B2 Sulfonated diarylrhodamine dyes APPLERA CORPORATION (US) 2006-03-28 US disclosed
US-20040096397-A1 Sulfonated diarylrhodamine dyes APPLERA CORPORATION (US) 2004-05-20 US disclosed
EP-1339798-A2 SULFONATED DIARYLRHODAMINE DYES Applera Corporation (US) 2003-09-03 EP disclosed
US-6583168-B1 Fluorescent labels of nucleosides, nucleotides, polynucleotides, and polypeptides in nucleic acid analysis APPLERA CORPORATION 2003-06-24 US disclosed
WO-2002044416-A2 SULFONATED DIARYLRHODAMINE DYES AS FLUORESCENT LABELS APPLERA CORPORATION (US) 2002-06-06 WO 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-20040096397-A1 Sulfonated diarylrhodamine dyes POLL, DUT, DPYD KDM4E 4647/4885CYP1A2 3635/4885CYP2C19 3939/4885

“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.