SCHEMBL3892306

SCHEMBL3892306

COC(=O)CCCCCCCCC(=O)c1cc(C)ccc1Oc1ccnc2cc(OC)c(OC)cc12

nearest known ligand 0.69

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SRC P12931 5/20 0.69
TGFBR1 P36897 5/20 0.69
PDGFRA P16234 4/20 0.52
KDR P35968 4/20 0.52
MET P08581 4/20 0.47
HDAC1 Q13547 1/20 0.47
AXL P30530 1/20 0.47
PDGFRB P09619 1/20 0.46
HDAC2 Q92769 1/20 0.45
HDAC10 Q969S8 1/20 0.45
HDAC11 Q96DB2 1/20 0.45
HDAC8 Q9BY41 1/20 0.45
HDAC6 Q9UBN7 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
SCHEMBL3896856 1.00 SRC (0.69) SRCTGFBR1PDGFRAKDRMET
SCHEMBL3890976 0.90 SRC (0.74) SRCTGFBR1PDGFRAKDRMET
SCHEMBL3901875 0.84 SRC (0.79) SRCTGFBR1PDGFRAKDRMET
SCHEMBL3891073 0.82 HDAC8 (0.55) HDAC1HDAC8
SCHEMBL3892218 0.82 HDAC8 (0.55) HDAC1HDAC8
SCHEMBL3895814 0.82 SRC (0.76) SRCTGFBR1PDGFRAKDRMET
SCHEMBL3895310 0.82 SRC (0.82) SRCTGFBR1PDGFRAKDRAXL
SCHEMBL3894144 0.82 SRC (1.00) SRCTGFBR1PDGFRAKDRMET
SCHEMBL3896201 0.80 SRC (0.66) SRCTGFBR1PDGFRAKDRMET
SCHEMBL3905198 0.80 SRC (0.76) SRCTGFBR1PDGFRAKDRMET

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-20090312313-A1 COMPOUND HAVING TGFBETA INHIBITORY ACTIVITY AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME KIRIN BEER KABUSHIKI KAISHA (JP) 2009-12-17 US disclosed
US-7560558-B2 Compound having TGFβ inhibitory activity and medicinal composition containing the same KIRIN BEER KABUSHIKI KAISHA (JP) 2009-07-14 US disclosed
US-20060111375-A1 Compound having tgfß inhibitory activity and medicinal composition containing the same KIRIN BEER KABUSHIKI KAISHA (JP) 2006-05-25 US disclosed
EP-1548008-A1 COMPOUND HAVING TGF-BETA INHIBITORY ACTIVITY AND MEDICINAL COMPOSITION CONTAINING THE SAME KIRIN BEER KABUSHIKI KAISHA (JP) 2005-06-29 EP 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 (2 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-20060111375-A1 Compound having tgfß inhibitory activity and medicinal composition containing the same TGFB1, TGFBR1, TGFBR2 SRC 399/4885TGFBR1 2/4885PDGFRA 36/4885
US-20090312313-A1 COMPOUND HAVING TGFBETA INHIBITORY ACTIVITY AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME TGFB1, TGFBR1, TGFBR2 SRC 496/4885TGFBR1 2/4885PDGFRA 32/4885

“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.