SCHEMBL5828504

SCHEMBL5828504

COc1ccc(-c2ccc3cc(C=C4SC(=O)NC4=O)ccc3c2)cc1C1(C)CCCCC1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 4/20 0.57
PIM2 Q9P1W9 4/20 0.57
PIM3 Q86V86 2/20 0.57
PDE4B Q07343 2/20 0.57
RARA P10276 1/20 0.56
RARB P10826 1/20 0.56
RARG P13631 1/20 0.56
GSK3B P49841 3/20 0.51
CDC7 O00311 1/20 0.51
DAPK3 O43293 1/20 0.51
DYRK3 O43781 1/20 0.51
MAP4K4 O95819 1/20 0.51
PHKG2 P15735 1/20 0.51
RPS6KB1 P23443 1/20 0.51
CSNK1D P48730 1/20 0.51
CLK2 P49760 1/20 0.51
GSK3A P49840 1/20 0.51
NEK4 P51957 1/20 0.51
CSNK2A1 P68400 1/20 0.51
CSNK1G2 P78368 1/20 0.51

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
SCHEMBL5828501 1.00 PIM1 (0.57) PIM1PIM2PIM3PDE4BRARA
SCHEMBL5828392 0.91 PDE4B (0.59) PIM1PIM2PIM3PDE4BRARA
SCHEMBL5827791 0.82 RARB (0.66) RARARARBRARGHPGD
SCHEMBL5828067 0.81 MEN1 (0.57) PIM1PIM2PIM3PDE4BRARA
SCHEMBL5828070 0.81 MEN1 (0.57) PIM1PIM2PIM3PDE4BRARA
SCHEMBL5828779 0.79 PIM1 (0.61) PIM1PIM2PIM3PDE4BGSK3B
SCHEMBL5828783 0.79 PIM1 (0.61) PIM1PIM2PIM3PDE4BGSK3B
SCHEMBL5828110 0.78 PIM1 (0.60) PIM1PIM2PIM3PDE4BGSK3B
SCHEMBL5828108 0.78 PIM1 (0.60) PIM1PIM2PIM3PDE4BGSK3B
SCHEMBL5494609 0.74 PIM1 (0.60) PIM1PIM2PIM3PDE4BRARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1385465-A4 HETEROCYCLIC DERIVATIVES FOR THE TREATMENT OF CANCER AND OTHER PROLIFERATIVE DISEASES INCYTE SAN DIEGO INC (US) 2005-09-07 EP claimed
EP-1385465-A2 HETEROCYCLIC DERIVATIVES FOR THE TREATMENT OF CANCER AND OTHER PROLIFERATIVE DISEASES Incyte San Diego, Inc. (US) 2004-02-04 EP claimed
US-20020143182-A1 Heterocyclic derivatives for the treatment of cancer and other proliferative diseases INCYTE GENOMICS, INC. 2002-10-03 US claimed
WO-2002072009-A2 HETEROCYCLIC DERIVATIVES FOR THE TREATMENT OF CANCER AND OTHER PROLIFERATIVE DISEASES MAXIA PHARMACEUTICALS, INC. (US) 2002-09-19 WO claimed
US-7153875-B2 Heterocyclic derivatives for the treatment of cancer and other proliferative diseases INCYTE SAN DIEGO (US) 2006-12-26 US disclosed
EP-1385465-A4 HETEROCYCLIC DERIVATIVES FOR THE TREATMENT OF CANCER AND OTHER PROLIFERATIVE DISEASES INCYTE SAN DIEGO INC (US) 2005-09-07 EP disclosed
EP-1385465-A2 HETEROCYCLIC DERIVATIVES FOR THE TREATMENT OF CANCER AND OTHER PROLIFERATIVE DISEASES Incyte San Diego, Inc. (US) 2004-02-04 EP disclosed
US-20020143182-A1 Heterocyclic derivatives for the treatment of cancer and other proliferative diseases INCYTE GENOMICS, INC. 2002-10-03 US disclosed
WO-2002072009-A2 HETEROCYCLIC DERIVATIVES FOR THE TREATMENT OF CANCER AND OTHER PROLIFERATIVE DISEASES MAXIA PHARMACEUTICALS, INC. (US) 2002-09-19 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-20020143182-A1 Heterocyclic derivatives for the treatment of cancer and other proliferative diseases CCNY, HRAS, AHR PIM1 3324/4885PIM2 3549/4885PIM3 2610/4885

“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.