SCHEMBL5828516

SCHEMBL5828516

Cc1cc(O)c(C23CC4CC(CC(C4)C2)C3)cc1-c1ccc(C=C2SC(=O)NC2=O)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 1/20 0.65
PTPRCAP Q14761 1/20 0.65
GLS O94925 2/20 0.48
GLS2 Q9UI32 2/20 0.48
IKBKB O14920 2/20 0.47
RARA P10276 1/20 0.47
GSK3B P49841 4/20 0.45
PIM1 P11309 4/20 0.45
PIM2 Q9P1W9 4/20 0.45
HPGD P15428 3/20 0.45
AKR1B1 P15121 2/20 0.45
RAB9A P51151 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
PIM3 Q86V86 2/20 0.45
CDC7 O00311 1/20 0.45
DAPK3 O43293 1/20 0.45
DYRK3 O43781 1/20 0.45
MAP4K4 O95819 1/20 0.45
PHKG2 P15735 1/20 0.45
RPS6KB1 P23443 1/20 0.45

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
SCHEMBL5828513 1.00 PTPN11 (0.65) PTPN11PTPRCAPGLSGLS2IKBKB
SCHEMBL5828517 0.90 PTPN11 (0.53) PTPN11PTPRCAPGLSGLS2IKBKB
SCHEMBL5827669 0.87 PTPN11 (0.79) PTPN11PTPRCAPGLSGLS2GSK3B
SCHEMBL5827668 0.87 PTPN11 (0.79) PTPN11PTPRCAPGLSGLS2GSK3B
SCHEMBL5828122 0.84 PTPN11 (0.77) PTPN11PTPRCAPRARAGSK3BPIM1
SCHEMBL5828120 0.84 PTPN11 (0.77) PTPN11PTPRCAPRARAGSK3BPIM1
SCHEMBL5828564 0.82 PTPN11 (0.85) PTPN11PTPRCAPGLSGLS2RARA
SCHEMBL5828563 0.82 PTPN11 (0.85) PTPN11PTPRCAPGLSGLS2RARA
SCHEMBL5827989 0.79 PTPN11 (0.76) PTPN11PTPRCAPGLSGLS2GSK3B
SCHEMBL5827991 0.79 PTPN11 (0.76) PTPN11PTPRCAPGLSGLS2GSK3B

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 6 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
US-20020143182-A1 Heterocyclic derivatives for the treatment of cancer and other proliferative diseases INCYTE GENOMICS, INC. 2002-10-03 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-20020143182-A1 Heterocyclic derivatives for the treatment of cancer and other proliferative diseases CCNY, HRAS, AHR PTPN11 1985/4885PTPRCAP 3488/4885GLS 323/4885

“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.