SCHEMBL650221

SCHEMBL650221

O=C1NC(=Nc2ccc(OC3CCC(C(=O)O)CC3)cc2C(F)(F)F)SC1=Cc1cnc(NC(=O)C2CC2)s1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 3/20 0.36
DYRK3 O43781 1/20 0.35
DGAT1 O75907 6/20 0.34
ESRRA P11474 1/20 0.34
CNR1 P21554 1/20 0.32
TXK P42681 1/20 0.32
JAK3 P52333 1/20 0.32
ITK Q08881 1/20 0.32
ACSL1 P33121 1/20 0.32
HPGD P15428 2/20 0.32
FAAH O00519 1/20 0.32
SOAT1 P35610 1/20 0.32
MAPT P10636 3/20 0.32
PTPN7 P35236 1/20 0.32
DUSP3 P51452 1/20 0.32
PTPN12 Q05209 1/20 0.32
PTPN22 Q9Y2R2 1/20 0.32
RECQL P46063 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
LMNA P02545 1/20 0.31

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
SCHEMBL10176525 1.00 ABL1 (0.36) ABL1DYRK3DGAT1ESRRACNR1
SCHEMBL10176526 0.92 KDR (0.39) ABL1DYRK3TXKJAK3ITK
SCHEMBL699754 0.90 KDR (0.38) ABL1DYRK3TXKJAK3ITK
SCHEMBL653891 0.89 MAPT (0.41) ABL1HPGDMAPTRECQLNPSR1
SCHEMBL653892 0.89 MAPT (0.41) ABL1HPGDMAPTRECQLNPSR1
SCHEMBL649834 0.85 DYRK3 (0.34) DYRK3ESRRACNR1ACSL1HPGD
SCHEMBL652215 0.83 HPGD (0.36) ABL1DYRK3TXKJAK3ITK
SCHEMBL10176524 0.81 MAPT (0.40) ABL1HPGDMAPTRECQLNPSR1
SCHEMBL10176480 0.81 MAPT (0.41) ABL1HPGDMAPTRECQLNPSR1
SCHEMBL651145 0.81 RNASEL (0.40) ABL1DYRK3HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 ABL1 978/4885DYRK3 1808/4885DGAT1 2746/4885

“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.