SCHEMBL3131271

SCHEMBL3131271

CCN1C(=O)S/C(=C\c2ccc(-c3cccc(F)c3)o2)C1=S

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 5/20 0.48
▸ KMT2A Q03164 5/20 0.48
▸ POLB P06746 5/20 0.48
▸ RAB9A P51151 3/20 0.48
▸ L3MBTL1 Q9Y468 3/20 0.48
▸ NPC1 O15118 2/20 0.48
▸ GPR55 Q9Y2T6 1/20 0.48
▸ ALDH1A1 P00352 2/20 0.48
▸ SMN1; SMN2 Q16637 2/20 0.48
▸ ITGB2 P05107 2/20 0.47
▸ ITGAM P11215 2/20 0.47
▸ STAT3 P40763 1/20 0.46
▸ MAPT P10636 2/20 0.46
▸ APEX1 P27695 1/20 0.46
▸ MAP3K5 Q99683 2/20 0.45
▸ LMNA P02545 1/20 0.45
▸ TNFRSF1A P19438 1/20 0.45
▸ DUSP3 P51452 1/20 0.44
▸ PKM P14618 1/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44

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
SCHEMBL3131279 1.00 MEN1 (0.48) MEN1KMT2APOLBRAB9AL3MBTL1
SCHEMBL3131284 1.00 MEN1 (0.48) MEN1KMT2APOLBRAB9AL3MBTL1
SCHEMBL3135572 0.88 MAPT (0.60) MEN1KMT2APOLBRAB9AL3MBTL1
SCHEMBL3135564 0.88 MAPT (0.60) MEN1KMT2APOLBRAB9AL3MBTL1
SCHEMBL3135576 0.88 MAPT (0.60) MEN1KMT2APOLBRAB9AL3MBTL1
SCHEMBL3133011 0.87 ITGB2 (0.60) MEN1KMT2APOLBRAB9AL3MBTL1
SCHEMBL3133014 0.87 ITGB2 (0.60) MEN1KMT2APOLBRAB9AL3MBTL1
SCHEMBL3133007 0.87 ITGB2 (0.60) MEN1KMT2APOLBRAB9AL3MBTL1
SCHEMBL3123752 0.86 PIK3CG (0.59) MEN1KMT2APOLBRAB9AL3MBTL1
SCHEMBL3123759 0.86 PIK3CG (0.59) MEN1KMT2APOLBRAB9AL3MBTL1

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 MEN1 4512/4885KMT2A 2561/4885POLB 4238/4885

“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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