SCHEMBL13296177

SCHEMBL13296177

O=C(/C=C/c1ccc(-c2cccs2)cc1)c1ccc(S)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC2 Q92769 2/20 0.64
TNFRSF1A P19438 9/20 0.63
F3 P13726 1/20 0.46
MAPT P10636 6/20 0.46
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
TP53 P04637 3/20 0.46
MAPK1 P28482 3/20 0.46
ALDH1A1 P00352 2/20 0.46
CYP3A4 P08684 2/20 0.46
ABCG2 Q9UNQ0 1/20 0.46
KDM4E B2RXH2 1/20 0.46
GAA P10253 1/20 0.46
HPGD P15428 1/20 0.46
ALOX15 P16050 1/20 0.46
HSD17B10 Q99714 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
NPC1 O15118 1/20 0.45
NFKB1 P19838 1/20 0.45
RAB9A P51151 1/20 0.45

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
SCHEMBL6040819 0.88 TNFRSF1A (0.65) HDAC2TNFRSF1AF3MAPTMEN1
SCHEMBL4727774 0.88 TNFRSF1A (0.65) HDAC2TNFRSF1AF3MAPTMEN1
SCHEMBL6040823 0.88 TNFRSF1A (0.65) HDAC2TNFRSF1AF3MAPTMEN1
SCHEMBL25202047 0.88 TNFRSF1A (0.65) HDAC2TNFRSF1AF3MAPTMEN1
SCHEMBL4727769 0.88 TNFRSF1A (0.65) HDAC2TNFRSF1AF3MAPTMEN1
SCHEMBL25190515 0.88 TNFRSF1A (0.65) HDAC2TNFRSF1AF3MAPTMEN1
SCHEMBL6040629 0.86 TNFRSF1A (0.63) HDAC2TNFRSF1AF3MAPTMEN1
SCHEMBL6040624 0.86 TNFRSF1A (0.63) HDAC2TNFRSF1AF3MAPTMEN1
SCHEMBL6040804 0.82 TNFRSF1A (0.58) HDAC2TNFRSF1AF3MAPTMEN1
SCHEMBL6040810 0.82 TNFRSF1A (0.58) HDAC2TNFRSF1AF3MAPTMEN1

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 36 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7737283-B2 Anti-inflammatory medicaments DECIPHERA PHARMACEUTICALS, LLC (US) 2010-06-15 US disclosed
US-7737283-B2 Anti-inflammatory medicaments DECIPHERA PHARMACEUTICALS, LLC (US) 2010-06-15 US disclosed
US-7666895-B2 Anti-inflammatory medicaments DECIPHERA PHARMACEUTICALS, LLC (US) 2010-02-23 US disclosed
US-7666895-B2 Anti-inflammatory medicaments DECIPHERA PHARMACEUTICALS, LLC (US) 2010-02-23 US disclosed
US-20090137021-A1 Anti-inflammatory medicaments DECIPHERA PHARMACEUTICALS, LLC 2009-05-28 US disclosed
US-20090137021-A1 Anti-inflammatory medicaments DECIPHERA PHARMACEUTICALS, LLC 2009-05-28 US disclosed
US-7531566-B2 Anti-inflammatory medicaments DECIPHERA PHARMACEUTICALS, LLC (US) 2009-05-12 US disclosed
US-7531566-B2 Anti-inflammatory medicaments DECIPHERA PHARMACEUTICALS, LLC (US) 2009-05-12 US disclosed
US-20090105230-A1 Anti-inflammatory medicaments FLYNN DANIEL L 2009-04-23 US disclosed
US-20090105230-A1 Anti-inflammatory medicaments FLYNN DANIEL L 2009-04-23 US disclosed
US-20080045531-A1 Anti-inflammatory medicaments DECIPHERA PHARMACEUTICALS, LLC 2008-02-21 US disclosed
US-20080045531-A1 Anti-inflammatory medicaments DECIPHERA PHARMACEUTICALS, LLC 2008-02-21 US disclosed
US-7279576-B2 Anti-cancer medicaments DECIPHERA PHARMACEUTICALS, LLC (US) 2007-10-09 US disclosed
US-7279576-B2 Anti-cancer medicaments DECIPHERA PHARMACEUTICALS, LLC (US) 2007-10-09 US disclosed
US-20070191336-A1 p38 kinase inhibitors DECIPHERA PHARMACEUTICALS, LLC 2007-08-16 US disclosed
US-20070191336-A1 p38 kinase inhibitors DECIPHERA PHARMACEUTICALS, LLC 2007-08-16 US disclosed
US-7202257-B2 Anti-inflammatory medicaments DECIPHERA PHARMACEUTICALS, LLC (US) 2007-04-10 US disclosed
US-7202257-B2 Anti-inflammatory medicaments DECIPHERA PHARMACEUTICALS, LLC (US) 2007-04-10 US disclosed
US-20070037808-A1 p38 kinase inhibitors DECIPHERA PHARMACEUTICALS, LLC 2007-02-15 US disclosed
US-20070037808-A1 p38 kinase inhibitors DECIPHERA PHARMACEUTICALS, LLC 2007-02-15 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 (5 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-20090105230-A1 Anti-inflammatory medicaments MIF, PTGES2, TNF HDAC2 2007/4885TNFRSF1A 834/4885F3 3422/4885
US-20070037808-A1 p38 kinase inhibitors MAPK1, MAP3K8, MAP3K1 HDAC2 2088/4885TNFRSF1A 412/4885F3 3301/4885
US-20080045531-A1 Anti-inflammatory medicaments MIF, PTGES2, TNF HDAC2 2007/4885TNFRSF1A 834/4885F3 3422/4885
US-20070191336-A1 p38 kinase inhibitors MAPK1, MAP3K8, MAP3K1 HDAC2 2088/4885TNFRSF1A 412/4885F3 3301/4885
US-20090137021-A1 Anti-inflammatory medicaments MIF, PTGES2, TNF HDAC2 2007/4885TNFRSF1A 834/4885F3 3422/4885

“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.