SCHEMBL5129161

SCHEMBL5129161

O=C1CN(c2csc(-c3ccccc3)c2)S(=O)(=O)N1

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 11/20 0.61
AR P10275 1/20 0.45
PTPN2 P17706 8/20 0.36
SLC40A1 Q9NP59 1/20 0.35
GABRA1 P14867 1/20 0.33
GABRG2 P18507 1/20 0.33
GABRB3 P28472 1/20 0.33
HTR3E A5X5Y0 1/20 0.31
HTR3B O95264 1/20 0.31
CHRNA7 P36544 1/20 0.31
HTR3A P46098 1/20 0.31
HTR3D Q70Z44 1/20 0.31
HTR3C Q8WXA8 1/20 0.31
CNR1 P21554 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
SCHEMBL5121857 0.81 PTPN1 (0.40) PTPN1PTPN2
SCHEMBL6689304 0.78 PTPN1 (0.81) PTPN1PTPN2SLC40A1
SCHEMBL1732116 0.77 PTPN1 (1.00) PTPN1PTPN2SLC40A1
SCHEMBL1731402 0.76 PTPN1 (0.96) PTPN1PTPN2SLC40A1
SCHEMBL6672718 0.71 PTPN1 (0.59) PTPN1HTR3EHTR3BHTR3AHTR3D
SCHEMBL5127535 0.71 AR (0.40) PTPN1ARGABRA1GABRG2GABRB3
SCHEMBL5116344 0.71 PTPN1 (0.51) PTPN1PTPN2
SCHEMBL643464 0.70 PTPN1 (0.66) PTPN1PTPN2
SCHEMBL3572033 0.70 PTPN1 (0.66) PTPN1PTPN2SLC40A1HTR3EHTR3B
SCHEMBL1688153 0.70 PTPN1 (0.66) PTPN1

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-20080004325-A1 PTP1B inhibitors WYETH (US) 2008-01-03 US claimed
US-20080004325-A1 PTP1B inhibitors WYETH (US) 2008-01-03 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-20080004325-A1 PTP1B inhibitors PTPA, PTPRJ, PTPRR PTPN1 18/4885AR 3130/4885PTPN2 14/4885

“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.