SCHEMBL3134588

SCHEMBL3134588

CCN1C(=O)S/C(=C/c2ccc(-c3ccccc3)s2)C1=S

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 1/20 0.55
▸ PTPN1 P18031 1/20 0.43
▸ PTPN22 Q9Y2R2 7/20 0.42
▸ TNFRSF1A P19438 3/20 0.41
▸ HPGD P15428 2/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ PRF1 P14222 2/20 0.41
▸ PPARG P37231 1/20 0.38

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
SCHEMBL3134581 1.00 TDP1 (0.55) TDP1PTPN1PTPN22TNFRSF1AHPGD
SCHEMBL3134593 1.00 TDP1 (0.55) TDP1PTPN1PTPN22TNFRSF1AHPGD
SCHEMBL3135714 0.82 TNFRSF1A (0.57) TDP1PTPN1PTPN22TNFRSF1AMEN1
SCHEMBL3135718 0.82 TNFRSF1A (0.57) TDP1PTPN1PTPN22TNFRSF1AMEN1
SCHEMBL3135706 0.82 TNFRSF1A (0.57) TDP1PTPN1PTPN22TNFRSF1AMEN1
SCHEMBL12177152 0.76 PPARG (0.60) TDP1PTPN1PTPN22ALDH1A1PPARG
SCHEMBL3133011 0.76 ITGB2 (0.60) TNFRSF1AMEN1NPC1ALDH1A1LMNA
SCHEMBL3133014 0.76 ITGB2 (0.60) TNFRSF1AMEN1NPC1ALDH1A1LMNA
SCHEMBL3133007 0.76 ITGB2 (0.60) TNFRSF1AMEN1NPC1ALDH1A1LMNA
SCHEMBL12177157 0.75 ALDH1A1 (0.52) TDP1PTPN22HPGDMEN1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120219613-A1 Novel Antiviral Agents for Enveloped Viruses THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2012-08-30 — — US claimed
WO-2010044924-A1 NOVEL ANTIVIRAL AGENTS FOR ENVELOPED VIRUSES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2010-04-22 — — WO claimed
US-20120219613-A1 Novel Antiviral Agents for Enveloped Viruses THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2012-08-30 — — US disclosed
WO-2010044924-A1 NOVEL ANTIVIRAL AGENTS FOR ENVELOPED VIRUSES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2010-04-22 — — 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-20120219613-A1 Novel Antiviral Agents for Enveloped Viruses MAVS, LAMP1, HAVCR2 TDP1 1886/4885PTPN1 1273/4885PTPN22 2425/4885

“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.

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