SCHEMBL3391957

SCHEMBL3391957

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nearest known ligand 0.58

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.58
TSHR P16473 1/20 0.58
TDP1 Q9NUW8 1/20 0.32
PDE4A P27815 1/20 0.31
TP53 P04637 1/20 0.30

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
SCHEMBL3392724 1.00 CYP2C9 (0.58) CYP2C9TSHRTDP1PDE4ATP53
SCHEMBL5958021 1.00 CYP2C9 (0.58) CYP2C9TSHRTDP1PDE4ATP53
SCHEMBL3094197 1.00 CYP2C9 (0.58) CYP2C9TSHRTDP1PDE4ATP53
SCHEMBL10778434 1.00 CYP2C9 (0.58) CYP2C9TSHRTDP1PDE4ATP53
SCHEMBL12189710 1.00 CYP2C9 (0.58) CYP2C9TSHRTDP1PDE4ATP53
SCHEMBL3390693 1.00 CYP2C9 (0.58) CYP2C9TSHRTDP1PDE4ATP53
SCHEMBL4733654 1.00 CYP2C9 (0.58) CYP2C9TSHRTDP1PDE4ATP53
SCHEMBL3395036 1.00 CYP2C9 (0.58) CYP2C9TSHRTDP1PDE4ATP53
SCHEMBL17866821 0.92 CYP2C9 (0.56) CYP2C9TSHRTDP1PDE4A
SCHEMBL21000832 0.92 CYP2C9 (0.56) CYP2C9TSHRTDP1PDE4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100105885-A1 DEOXYKETOHEXOSE ISOMERASE AND METHOD FOR PRODUCING DEOXYHEXOSE AND DERIVATIVE THEREOF USING SAME NAT'L UNIVERSITY CORPORATION KAGAWA UNIVERSITY (JP) 2010-04-29 US claimed
EP-2161332-A1 DEOXYKETOHEXOSE ISOMERASE AND METHOD FOR PRODUCING DEOXYKETOHEXOSE AND DERIVATIVE THEREOF USING THE SAME National University Corporation Kagawa University (JP) 2010-03-10 EP claimed
EP-2161332-B1 DEOXYKETOHEXOSE ISOMERASE AND METHOD FOR PRODUCING DEOXYHEXOSE AND DERIVATIVE THEREOF USING SAME UNIV KAGAWA NAT UNIV CORP (JP) 2015-04-22 EP disclosed
US-8389248-B2 Deoxyketohexose isomerase and method for producing deoxyhexose and derivative thereof using same NATIONAL UNIVERSITY CORPORATION KAGAWA UNIVERSITY (JP) 2013-03-05 US disclosed
US-20100105885-A1 DEOXYKETOHEXOSE ISOMERASE AND METHOD FOR PRODUCING DEOXYHEXOSE AND DERIVATIVE THEREOF USING SAME NAT'L UNIVERSITY CORPORATION KAGAWA UNIVERSITY (JP) 2010-04-29 US disclosed
EP-2161332-A1 DEOXYKETOHEXOSE ISOMERASE AND METHOD FOR PRODUCING DEOXYKETOHEXOSE AND DERIVATIVE THEREOF USING THE SAME National University Corporation Kagawa University (JP) 2010-03-10 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 (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-20100105885-A1 DEOXYKETOHEXOSE ISOMERASE AND METHOD FOR PRODUCING DEOXYHEXOSE AND DERIVATIVE THEREOF USING SAME ALDOA, TALDO1, GPI CYP2C9 2381/4885TSHR 2896/4885TDP1 1706/4885

“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.