SCHEMBL651624

SCHEMBL651624

O=C(O)CCC(=O)Nc1ncc(C=C2SC(=Nc3ccc4ncccc4c3)NC2=O)s1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DYRK3 O43781 5/20 0.48
CDK1 P06493 4/20 0.47
PRKCD Q05655 3/20 0.47
MAPK1 P28482 3/20 0.47
CCNB1 P14635 2/20 0.47
CCNE1 P24864 2/20 0.47
CDK2 P24941 2/20 0.47
CDK5 Q00535 2/20 0.47
GSK3B P49841 2/20 0.47
AURKA O14965 1/20 0.47
CCNT1 O60563 1/20 0.47
CCNA2 P20248 1/20 0.47
GSK3A P49840 1/20 0.47
CDK7 P50613 1/20 0.47
CDK9 P50750 1/20 0.47
CCNH P51946 1/20 0.47
MNAT1 P51948 1/20 0.47
CDK5R1 Q15078 1/20 0.47
AURKB Q96GD4 1/20 0.47
CLK1 P49759 2/20 0.41

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
SCHEMBL651623 1.00 DYRK3 (0.48) DYRK3CDK1PRKCDMAPK1CCNB1
SCHEMBL10176314 1.00 DYRK3 (0.48) DYRK3CDK1PRKCDMAPK1CCNB1
SCHEMBL10176312 0.90 PTPN7 (0.49) DYRK3MAPK1GSK3BDYRK1ACLK4
SCHEMBL652616 0.90 PTPN7 (0.49) DYRK3MAPK1GSK3BDYRK1ACLK4
SCHEMBL652615 0.90 PTPN7 (0.49) DYRK3MAPK1GSK3BDYRK1ACLK4
SCHEMBL653261 0.86 NPC1 (0.50) DYRK3CDK1GSK3BGSK3AAURKB
SCHEMBL653260 0.86 NPC1 (0.50) DYRK3CDK1GSK3BGSK3AAURKB
SCHEMBL13091415 0.85 PTPN11 (0.42) DYRK3CDK1MAPK1GSK3BGSK3A
SCHEMBL650953 0.85 PTPN7 (0.37) MAPK1AURKAAURKBPTPN7DUSP3
SCHEMBL10176294 0.85 PTPN7 (0.37) MAPK1AURKAAURKBPTPN7DUSP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2423204-A1 THIAZOLIDINONE DERIVATIVE SBI Biotech Co., Ltd. (JP) 2012-02-29 EP disclosed
US-8119812-B2 Thiazolidinone derivative SBI BIOTECH CO., LTD. (JP) 2012-02-21 US disclosed
US-20110190299-A1 THIAZOLIDINONE DERIVATIVE SBI BIOTECH CO., LTD. (JP) 2011-08-04 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-20110190299-A1 THIAZOLIDINONE DERIVATIVE CDC7, CDK17, CDCA2 DYRK3 1808/4885CDK1 8/4885PRKCD 903/4885

“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.