SCHEMBL7797355

SCHEMBL7797355

Cc1c(C(N)=O)sc2cncc(Oc3ccc(C#N)cc3)c12

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ICAM1 P05362 16/20 0.60
SELE P16581 16/20 0.60
VCAM1 P19320 7/20 0.60
CCNC P24863 7/20 0.60
CDK8 P49336 7/20 0.60
PARP15 Q460N3 1/20 0.44
PARP10 Q53GL7 1/20 0.44
PARP2 Q9UGN5 1/20 0.44
IKBKB O14920 1/20 0.42
CDC7 O00311 1/20 0.42
DYRK3 O43781 1/20 0.42
ROCK2 O75116 1/20 0.42
MAP4K4 O95819 1/20 0.42
FYN P06241 1/20 0.42
CDK1 P06493 1/20 0.42
PIM1 P11309 1/20 0.42
PRKACA P17612 1/20 0.42
CDK2 P24941 1/20 0.42
FLT4 P35916 1/20 0.42
MAPK9 P45984 1/20 0.42

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
SCHEMBL7052567 0.85 CDK8 (0.58) ICAM1SELEVCAM1CCNCCDK8
SCHEMBL7053701 0.85 ICAM1 (0.58) ICAM1SELEVCAM1CCNCCDK8
SCHEMBL7255489 0.83 ICAM1 (0.59) ICAM1SELEVCAM1CCNCCDK8
SCHEMBL7801846 0.82 CCNC (0.60) ICAM1SELEVCAM1CCNCCDK8
SCHEMBL7931909 0.81 ICAM1 (0.62) ICAM1SELEVCAM1CCNCCDK8
SCHEMBL7797411 0.79 ICAM1 (0.55) ICAM1SELEVCAM1CCNCCDK8
SCHEMBL7671865 0.79 SELE (0.57) ICAM1SELEVCAM1CCNCCDK8
SCHEMBL7681347 0.78 ICAM1 (0.55) ICAM1SELEVCAM1CCNCCDK8
SCHEMBL7797418 0.78 SELE (0.55) ICAM1SELEVCAM1CCNCCDK8
SCHEMBL7797361 0.78 ICAM1 (0.55) ICAM1SELEVCAM1CCNCCDK8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20010020030-A1 Cell adhesion-inhibiting antiinflammatory compounds ABBVIE INC. 2001-09-06 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-20010020030-A1 Cell adhesion-inhibiting antiinflammatory compounds ICAM1, VCAM1, EPCAM ICAM1 1/4885SELE 16/4885VCAM1 2/4885

“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.