SCHEMBL5828660

SCHEMBL5828660

O=C1NC(=O)/C(=C/c2ccc(-c3cc(F)c(O)c(C45CC6CC(CC(C6)C4)C5)c3)cc2)S1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 1/20 0.61
PTPRCAP Q14761 1/20 0.61
PIM1 P11309 3/20 0.46
PIM2 Q9P1W9 3/20 0.46
AKR1B1 P15121 2/20 0.46
HPGD P15428 1/20 0.46
GSK3B P49841 1/20 0.46
RAB9A P51151 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
MAOA P21397 2/20 0.44
MAOB P27338 2/20 0.44
CISD1 Q9NZ45 2/20 0.44
NAT1 P18440 1/20 0.44
PIK3CG P48736 2/20 0.43
PIK3CA P42336 1/20 0.43
MPL P40238 1/20 0.43
RARB P10826 1/20 0.43
PTGS1 P23219 1/20 0.42
PTGS2 P35354 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
SCHEMBL5828663 1.00 PTPN11 (0.61) PTPN11PTPRCAPPIM1PIM2AKR1B1
SCHEMBL5828666 0.90 PTPN11 (0.49) PTPN11PTPRCAPPIM1PIM2AKR1B1
SCHEMBL5827655 0.87 PTPN11 (0.69) PTPN11PTPRCAPPIM1PIM2AKR1B1
SCHEMBL5827654 0.87 PTPN11 (0.69) PTPN11PTPRCAPPIM1PIM2AKR1B1
SCHEMBL5828120 0.84 PTPN11 (0.77) PTPN11PTPRCAPPIM1PIM2AKR1B1
SCHEMBL5828122 0.84 PTPN11 (0.77) PTPN11PTPRCAPPIM1PIM2AKR1B1
SCHEMBL6619319 0.82 RARB (0.49) PTPN11PTPRCAPHPGDRARBHDAC3
SCHEMBL5828642 0.82 PTPN11 (0.79) PTPN11PTPRCAPPIM1PIM2AKR1B1
SCHEMBL5828641 0.82 PTPN11 (0.79) PTPN11PTPRCAPPIM1PIM2AKR1B1
SCHEMBL6635247 0.81 NAT1 (0.52) PTPN11PTPRCAPCISD1NAT1

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 3488/4885PIM1 3324/4885

“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.