SCHEMBL4179675

SCHEMBL4179675

COC[C@H](C)Oc1cc(OCc2ccccc2)cc(-c2cc3cccnc3[nH]2)c1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 15/20 0.48
CCNB2 O95067 1/20 0.48
CDK1 P06493 1/20 0.48
CCNB1 P14635 1/20 0.48
CCNB3 Q8WWL7 1/20 0.48
GCK P35557 2/20 0.42
RARA P10276 1/20 0.40
RARB P10826 1/20 0.40
CYP3A4 P08684 1/20 0.40
PRMT5 O14744 2/20 0.39

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
SCHEMBL13875664 0.88 CCNB2 (0.51) CCNB2CDK1CCNB1CCNB3GCK
SCHEMBL4181761 0.87 RIPK1 (0.52) RIPK1CCNB2CDK1CCNB1CCNB3
SCHEMBL2086747 0.84 PRMT5 (0.41) GCKRARARARBCYP3A4PRMT5
SCHEMBL14115572 0.78 RIPK1 (0.61) RIPK1CCNB2CDK1CCNB1CCNB3
SCHEMBL4186396 0.78 GCK (0.53) RIPK1CCNB2CDK1CCNB1CCNB3
SCHEMBL9071271 0.78 GCK (0.53) RIPK1CCNB2CDK1CCNB1CCNB3
SCHEMBL2668031 0.76 GCK (0.37) RIPK1GCKRARARARBPRMT5
SCHEMBL2087030 0.76 GCK (0.46) RIPK1CCNB2CDK1CCNB1CCNB3
SCHEMBL2087106 0.76 GCK (0.38) GCKRARARARBCYP3A4PRMT5
SCHEMBL2086138 0.76 AURKA (0.39) CCNB2CDK1CCNB1CCNB3GCK

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-20090105263-A1 HETEROBICYCLIC COMPOUNDS AS GLUCOKINASE ACTIVATORS ASTRAZENECA AB (SE) 2009-04-23 US claimed
US-20090105263-A1 HETEROBICYCLIC COMPOUNDS AS GLUCOKINASE ACTIVATORS ASTRAZENECA AB (SE) 2009-04-23 US disclosed
US-20090105263-A1 HETEROBICYCLIC COMPOUNDS AS GLUCOKINASE ACTIVATORS ASTRAZENECA AB (SE) 2009-04-23 US disclosed
US-20090105263-A1 HETEROBICYCLIC COMPOUNDS AS GLUCOKINASE ACTIVATORS ASTRAZENECA AB (SE) 2009-04-23 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-20090105263-A1 HETEROBICYCLIC COMPOUNDS AS GLUCOKINASE ACTIVATORS GCK, GCKR, GALK1 RIPK1 895/4885CCNB2 824/4885CDK1 273/4885

“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.