SCHEMBL13745736

SCHEMBL13745736

O=C(O)c1ccc(-c2cn(OOSc3ccccc3)c3ncc(-c4ccccc4Oc4ccccc4)cc23)cc1

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CAMKK2 Q96RR4 3/20 0.55
▸ FEN1 P39748 3/20 0.44
▸ PTPN11 Q06124 10/20 0.40
▸ FFAR4 Q5NUL3 1/20 0.37
▸ PTPRC P08575 1/20 0.36
▸ PTPN2 P17706 1/20 0.36
▸ PTPN1 P18031 1/20 0.36
▸ PTPN6 P29350 1/20 0.36
▸ PTPN7 P35236 1/20 0.36
▸ PPP2CA P67775 1/20 0.36
▸ PTPN12 Q05209 1/20 0.36
▸ DUSP22 Q9NRW4 1/20 0.36
▸ EGLN1 Q9GZT9 1/20 0.36

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
SCHEMBL13746336 0.91 CAMKK2 (0.47) CAMKK2FEN1PTPN11
SCHEMBL13745780 0.91 CAMKK2 (0.41) CAMKK2FEN1FFAR4
SCHEMBL13746535 0.89 CAMKK2 (0.41) CAMKK2FEN1FFAR4
SCHEMBL13745719 0.88 CAMKK2 (0.40) CAMKK2FEN1FFAR4
SCHEMBL13746204 0.88 KDR (0.41) CAMKK2PTPN11
SCHEMBL13746567 0.88 CAMKK2 (0.40) CAMKK2FEN1FFAR4
SCHEMBL13746565 0.87 CAMKK2 (0.39) CAMKK2PTPN11
SCHEMBL13746271 0.85 CAMKK2 (0.37) CAMKK2FEN1
SCHEMBL13746062 0.85 CAMKK2 (0.38) CAMKK2FEN1PTPN11FFAR4
SCHEMBL13745855 0.84 CAMKK2 (0.36) CAMKK2FEN1FFAR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090215771-A1 JNK INHIBITORS GRACZYK PIOTR 2009-08-27 — — US disclosed
US-7432375-B2 JNK inhibitors EISAI R & D MANAGEMENT CO., LTD. (JP) 2008-10-07 — — 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 (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-20090215771-A1 JNK INHIBITORS MAPKAPK2, MAPK1, MAPKAPK3 CAMKK2 94/4885FEN1 2804/4885PTPN11 1694/4885

“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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