SCHEMBL3392607

SCHEMBL3392607

CCOc1ccc(-c2nn(-c3ccccc3)cc2C=C2SC(=O)NC2=O)cc1Br

nearest known ligand 0.73

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CDC25B P30305 1/20 0.73
PTGES O14684 3/20 0.62
MAPT P10636 2/20 0.59
HPGD P15428 2/20 0.59
KDM4E B2RXH2 1/20 0.59
MEN1 O00255 1/20 0.59
CYP1A2 P05177 1/20 0.59
CYP2C19 P33261 1/20 0.59
KMT2A Q03164 1/20 0.59
RXFP1 Q9HBX9 1/20 0.59
P2RX3 P56373 1/20 0.53
PSD A5PKW4 1/20 0.53
PTGS2 P35354 1/20 0.51
PTP4A3 O75365 1/20 0.50
DUSP4 Q13115 1/20 0.50
PTP4A1 Q93096 1/20 0.50

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
SCHEMBL3392603 1.00 CDC25B (0.73) CDC25BPTGESMAPTHPGDKDM4E
SCHEMBL3390639 0.84 CDC25B (1.00) CDC25BPTGESMAPTHPGDKDM4E
SCHEMBL3390636 0.84 CDC25B (1.00) CDC25BPTGESMAPTHPGDKDM4E
SCHEMBL3388927 0.84 CDC25B (0.83) CDC25BPTGESMAPTHPGDKDM4E
SCHEMBL3388931 0.84 CDC25B (0.83) CDC25BPTGESMAPTHPGDKDM4E
SCHEMBL3389983 0.83 PTGES (0.61) CDC25BPTGESMAPTHPGDKDM4E
SCHEMBL3389978 0.83 PTGES (0.61) CDC25BPTGESMAPTHPGDKDM4E
SCHEMBL3394340 0.81 CDC25B (0.68) CDC25BMAPTHPGDKDM4EMEN1
SCHEMBL13345210 0.80 PLK1 (0.65) PTGESMAPTHPGDMEN1KMT2A
SCHEMBL3389872 0.78 CDC25B (0.87) CDC25BPTGESMAPTHPGDKDM4E

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-1861395-B1 5-(1,3-DIARYL-1H-PYRAZOL-4-YLMETHYLENE)-THIAZOLIDINE-2,4-DIONE DERIVATIVES USEFUL AS ANTICANCER AGENT KOREA RES INST CHEM TECH (KR) 2010-12-29 EP disclosed
US-7718681-B2 5-(1,3-Diaryl-1H-pyrazol-4-ylmethylene)-thiazolidine,2,4-dione derivatives useful as anticancer agent KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2010-05-18 US disclosed
US-20080275094-A1 5-(1,3-Diaryl-1H-Pyrazol-4-1 Methylene)-Thiazolidine-2,4-Dione Derivatives Useful as Anticancer Agent BARCLAYS BANK PLC (GB) 2008-11-06 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-20080275094-A1 5-(1,3-Diaryl-1H-Pyrazol-4-1 Methylene)-Thiazolidine-2,4-Dione Derivatives Useful as Anticancer Agent TP53, CDKN1A, API5 CDC25B 315/4885PTGES 3261/4885MAPT 2588/4885

“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.