SCHEMBL5578015

SCHEMBL5578015

NCC(=O)Nc1ccc(-c2cncn2-c2n[nH]c3nc(C(N)=O)sc23)c(Cl)c1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TERT O14746 1/20 0.34
ABL1 P00519 2/20 0.34
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
IDO1 P14902 1/20 0.32
DYRK1A Q13627 1/20 0.31
PIK3CD O00329 1/20 0.31
PIK3CA P42336 1/20 0.31
PIK3CB P42338 1/20 0.31
MET P08581 1/20 0.31
ALK Q9UM73 1/20 0.31
SUV39H2 Q9H5I1 1/20 0.31
MEN1 O00255 1/20 0.31
APOBEC3A P31941 1/20 0.31
KMT2A Q03164 1/20 0.31
APOBEC3G Q9HC16 1/20 0.31
MAPT P10636 3/20 0.30
LMNA P02545 1/20 0.30
NPC1 O15118 1/20 0.30
CASP3 P42574 1/20 0.30

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
Hydrochloric Acid SCHEMBL4754609 0.99 ABL1 (0.33) TERTABL1CA1CA2IDO1
SCHEMBL5578027 0.90 TERT (0.35) TERTABL1CA1CA2IDO1
Hydrochloric Acid SCHEMBL4754614 0.89 TERT (0.34) TERTABL1CA1CA2IDO1
SCHEMBL14454967 0.86 MEN1 (0.38) ABL1MEN1KMT2AMAPTLMNA
SCHEMBL5577960 0.82 GPBAR1 (0.36) IDO1
Hydrochloric Acid SCHEMBL5577970 0.82 CYP2C19 (0.32)
SCHEMBL5578030 0.77 HPGD (0.39) ALDH1A1
SCHEMBL5578177 0.75 DYRK1A (0.32) DYRK1A
SCHEMBL14454913 0.75 ABL1 (0.42) ABL1MEN1KMT2ALMNACASP3
SCHEMBL14454914 0.74 MEN1 (0.39) ABL1MEN1KMT2AMAPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070173488-A1 Pyrazolothiazole Protein Kinase Modulators SGX PHARMACEUTICALS, INC. (US) 2007-07-26 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-20070173488-A1 Pyrazolothiazole Protein Kinase Modulators MAP4K2, MAP4K5, MAP4K3 TERT 2325/4885ABL1 246/4885CA1 4771/4885

“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.