SCHEMBL5828573

SCHEMBL5828573

CC(C)(C)[Si](C)(C)Oc1ccc(-c2ccccc2C=C2SC(=O)NC2=O)cc1C12CC3CC(CC(C3)C1)C2

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 1/20 0.47
PTPRCAP Q14761 1/20 0.47
SCN9A Q15858 1/20 0.41
PTPN1 P18031 4/20 0.40
TTR P02766 2/20 0.39
GLS O94925 2/20 0.39
GLS2 Q9UI32 2/20 0.39
PIM1 P11309 1/20 0.38
PIM3 Q86V86 1/20 0.38
PIM2 Q9P1W9 1/20 0.38
GSK3B P49841 1/20 0.37
IGF1R P08069 2/20 0.37
NAT1 P18440 1/20 0.37
KCNH2 Q12809 1/20 0.37
KMT2A Q03164 3/20 0.37
MEN1 O00255 2/20 0.37
ALDH1A1 P00352 2/20 0.37
KDM4E B2RXH2 1/20 0.37
BLM P54132 1/20 0.37
PLA2G1B P04054 1/20 0.37

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
SCHEMBL5828571 1.00 PTPN11 (0.47) PTPN11PTPRCAPSCN9APTPN1TTR
SCHEMBL5828575 0.91 PTPN11 (0.39) PTPN11PTPRCAPSCN9APTPN1GLS
SCHEMBL5827849 0.84 HDAC11 (0.38) PTPN11KMT2AMEN1BLMLMNA
SCHEMBL5827658 0.79 PTPN11 (0.51) PTPN11PTPRCAPSCN9APTPN1TTR
SCHEMBL5827659 0.79 PTPN11 (0.51) PTPN11PTPRCAPSCN9APTPN1TTR
SCHEMBL404472 0.74 HDAC11 (0.49) PTPN11KMT2AMEN1ALDH1A1KDM4E
SCHEMBL5827671 0.73 HDAC11 (0.59) PTPN11PTPRCAPPIM1PIM3PIM2
SCHEMBL5827672 0.73 HDAC11 (0.59) PTPN11PTPRCAPPIM1PIM3PIM2
SCHEMBL399513 0.72 HDAC11 (0.47) PTPN11KMT2AMEN1ALDH1A1KDM4E
SCHEMBL6618558 0.71 HDAC11 (0.42) KMT2AMEN1ALDH1A1KDM4EBLM

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 PTPN11 1985/4885PTPRCAP 3488/4885SCN9A 3477/4885

“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.