SCHEMBL4208656

SCHEMBL4208656

O=c1[nH]cnc2c1sc1ccc(-c3ccccc3)cc12

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LIMK1 P53667 2/20 0.58
PIM1 P11309 9/20 0.56
PIM2 Q9P1W9 8/20 0.56
PIM3 Q86V86 6/20 0.56
CLK4 Q9HAZ1 1/20 0.53
PDPK1 O15530 4/20 0.53
RAB9A P51151 2/20 0.51
NPC1 O15118 1/20 0.51
MAPT P10636 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
ALDH1A1 P00352 1/20 0.48
LMNA P02545 1/20 0.48
HPGD P15428 1/20 0.48
RXFP1 Q9HBX9 1/20 0.47
KDM4E B2RXH2 1/20 0.46

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
SCHEMBL4208864 0.82 KRAS (0.51) LIMK1PIM1PIM2PIM3CLK4
SCHEMBL4207979 0.80 PARP1 (0.53) PIM1PIM2PIM3CLK4PDPK1
SCHEMBL4213078 0.80 PIM1 (0.59) PIM1PIM2PIM3CLK4ALDH1A1
SCHEMBL4219756 0.80 PIM1 (0.53) PIM1PIM2PIM3CLK4PDPK1
SCHEMBL4218616 0.77 PIM1 (0.55) PIM1PIM2PIM3CLK4PDPK1
SCHEMBL4208127 0.77 LIMK1 (0.59) LIMK1PIM1PIM2PIM3CLK4
SCHEMBL4208072 0.76 PARP1 (0.57) PIM1PIM2PIM3CLK4MAPT
SCHEMBL24589833 0.74 LIMK1 (0.60) LIMK1PIM1PIM2PIM3CLK4
SCHEMBL19024703 0.74 LIMK1 (0.72) LIMK1PIM1PIM2PIM3
SCHEMBL19805138 0.74 LIMK1 (0.56) LIMK1PIM1PIM2PIM3CLK4

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 1/4885PIM2 3/4885

“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.