SCHEMBL4208127

SCHEMBL4208127

O=c1[nH]cnc2c1sc1cc(-c3ccc(O)cc3)ccc12

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIMK1 P53667 14/20 0.59
PIM1 P11309 2/20 0.46
PIM3 Q86V86 2/20 0.46
PIM2 Q9P1W9 2/20 0.46
PDPK1 O15530 2/20 0.43
LIMK2 P53671 1/20 0.43
PARP1 P09874 1/20 0.42
CDC7 O00311 1/20 0.42
IKBKB O14920 1/20 0.42
AURKA O14965 1/20 0.42
DAPK3 O43293 1/20 0.42
DYRK3 O43781 1/20 0.42
ROCK2 O75116 1/20 0.42
RPS6KA5 O75582 1/20 0.42
PRKD3 O94806 1/20 0.42
MAP4K4 O95819 1/20 0.42
CDK1 P06493 1/20 0.42
FES P07332 1/20 0.42
RET P07949 1/20 0.42
IGF1R P08069 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
SCHEMBL4207625 0.90 PARP1 (0.49) LIMK1PIM1PIM3PIM2PDPK1
SCHEMBL4215069 0.79 ALDH1A1 (0.53) LIMK1PIM1PIM3PIM2PDPK1
SCHEMBL4207983 0.79 PIM1 (0.49) PIM1PIM3PIM2PDPK1PARP1
SCHEMBL4208656 0.77 LIMK1 (0.58) LIMK1PIM1PIM3PIM2PDPK1
SCHEMBL4205085 0.75 PIM1 (0.45) LIMK1PIM1PIM3PIM2PDPK1
SCHEMBL4208864 0.75 KRAS (0.51) LIMK1PIM1PIM3PIM2PDPK1
SCHEMBL4208101 0.74 PARP1 (0.41) LIMK1PIM1PIM3PIM2PDPK1
SCHEMBL12969687 0.74 LIMK1 (1.00) LIMK1
SCHEMBL2302798 0.71 KDM4A (0.51) PIM1PIM3PIM2PDPK1PARP1
SCHEMBL2063013 0.71 PDPK1 (0.77) PIM1PIM3PIM2PDPK1CDC7

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-20090030196-A1 PIM KINASE INHIBITORS AS CANCER CHEMOTHERAPEUTICS ABBOTT LABORATORIES (US) 2009-01-29 US claimed
US-20090030196-A1 PIM KINASE INHIBITORS AS CANCER CHEMOTHERAPEUTICS ABBOTT LABORATORIES (US) 2009-01-29 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-20090030196-A1 PIM KINASE INHIBITORS AS CANCER CHEMOTHERAPEUTICS PIM1, PIM3, PIM2 LIMK1 435/4885PIM1 1/4885PIM3 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.