SCHEMBL9900735

SCHEMBL9900735

Oc1c[c]nc(NC2CCCNC2)n1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
IDH2 P48735 1/20 0.40
CHEK2 O96017 3/20 0.40
PRKCZ Q05513 3/20 0.39
PRKD2 Q9BZL6 2/20 0.38
MAPK3 P27361 1/20 0.38
CDK7 P50613 8/20 0.37
CCNH P51946 7/20 0.37
MNAT1 P51948 6/20 0.37
CCNT1 O60563 7/20 0.36
CCNK O75909 7/20 0.36
CDK9 P50750 7/20 0.36
CDK12 Q9NYV4 7/20 0.36
CCNE1 P24864 6/20 0.36
CDK2 P24941 6/20 0.36
CRBN Q96SW2 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
SCHEMBL9901501 0.80 CDK7 (0.41) IDH2PRKCZCDK7CCNHMNAT1
SCHEMBL9901234 0.70 IL1B (0.42) IDH2CHEK2PRKCZPRKD2
SCHEMBL30259588 0.69 KDM4E (0.61) IDH2PRKCZCDK7CCNHMNAT1
SCHEMBL26604076 0.69 IDH2 (0.50) IDH2PRKCZCDK7CCNHMNAT1
SCHEMBL26604080 0.69 IDH2 (0.50) IDH2PRKCZCDK7CCNHMNAT1
SCHEMBL23197829 0.67 IDH2 (0.45) IDH2PRKCZMAPK3CDK7CCNH
SCHEMBL31197278 0.67 CDK7 (0.43) IDH2PRKCZCDK7CCNHMNAT1
SCHEMBL269583 0.66 CCNK (0.50) CDK7CCNHMNAT1CCNT1CCNK
SCHEMBL268925 0.66 CCNK (0.50) CDK7CCNHMNAT1CCNT1CCNK
SCHEMBL9900746 0.66 PRKCZ (0.43) CHEK2PRKCZPRKD2CDK7CCNH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9090593-B2 Bicyclic compounds as Pim inhibitors AMGEN INC. (US) 2015-07-28 US claimed
EP-2796456-A1 Bicyclic compounds as Pim inhibitors Amgen Inc. (US) 2014-10-29 EP claimed
US-20140031360-A1 BICYCLIC COMPOUNDS AS PIM INHIBITORS AMGEN INC. (US) 2014-01-30 US claimed
EP-2649065-A1 BICYCLIC COMPOUNDS AS PIM INHIBITORS Amgen Inc. (US) 2013-10-16 EP claimed
WO-2012078777-A1 BICYCLIC COMPOUNDS AS PIM INHIBITORS AMGEN INC. (US) 2012-06-14 WO claimed
US-9090593-B2 Bicyclic compounds as Pim inhibitors AMGEN INC. (US) 2015-07-28 US disclosed
EP-2796456-A1 Bicyclic compounds as Pim inhibitors Amgen Inc. (US) 2014-10-29 EP disclosed
US-20140031360-A1 BICYCLIC COMPOUNDS AS PIM INHIBITORS AMGEN INC. (US) 2014-01-30 US disclosed
EP-2649065-A1 BICYCLIC COMPOUNDS AS PIM INHIBITORS Amgen Inc. (US) 2013-10-16 EP disclosed
WO-2012078777-A1 BICYCLIC COMPOUNDS AS PIM INHIBITORS AMGEN INC. (US) 2012-06-14 WO 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-20140031360-A1 BICYCLIC COMPOUNDS AS PIM INHIBITORS PIM1, PIM2, PIM3 IDH2 82/4885CHEK2 1150/4885PRKCZ 86/4885

“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.