SCHEMBL4256594

SCHEMBL4256594

C=CCOC(=O)Nc1nc(C(=O)CC(=O)OCC)cs1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.48
CYP2C19 P33261 1/20 0.48
MAPK1 P28482 2/20 0.47
TSHR P16473 2/20 0.47
GAA P10253 2/20 0.45
ACHE P22303 1/20 0.45
SMN1; SMN2 Q16637 5/20 0.44
RAB9A P51151 4/20 0.44
NPC1 O15118 3/20 0.44
TDP1 Q9NUW8 1/20 0.42
MAPT P10636 3/20 0.42
PARP1 P09874 1/20 0.42
HSP90AA1 P07900 1/20 0.42
POLB P06746 1/20 0.42
LMNA P02545 1/20 0.41
HPGD P15428 1/20 0.40
ALDH1A1 P00352 1/20 0.40
EGFR P00533 1/20 0.40

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
SCHEMBL13609557 0.87 CYP1A2 (0.64) CYP1A2CYP2C19MAPK1TSHRGAA
SCHEMBL13609506 0.85 CYP1A2 (0.49) CYP1A2CYP2C19MAPK1TSHRGAA
SCHEMBL13609546 0.82 MAPK1 (0.69) MAPK1TSHRGAASMN1; SMN2NPC1
SCHEMBL13621662 0.82 CSNK2A2 (0.42) CYP1A2CYP2C19MAPK1TSHRGAA
SCHEMBL4255385 0.81 L3MBTL1 (0.54) CYP1A2CYP2C19MAPK1TSHRGAA
SCHEMBL4259414 0.79 CSNK2A2 (0.46) CYP1A2CYP2C19MAPK1TSHRGAA
SCHEMBL10085276 0.78 MAPK1 (0.50) CYP1A2CYP2C19MAPK1TSHRGAA
SCHEMBL13609562 0.77 MAPK1 (0.42) CYP1A2CYP2C19MAPK1TSHRGAA
SCHEMBL13609551 0.76 TSHR (0.42) CYP1A2CYP2C19MAPK1TSHRGAA
SCHEMBL9386914 0.75 GAA (0.57) CYP1A2CYP2C19MAPK1TSHRGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090281142-A1 THIAZOLE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2009-11-12 US disclosed
US-20090281142-A1 THIAZOLE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2009-11-12 US disclosed
CN-101228143-A Thiazole derivatives ASTELLAS PHARMA INC (JP) 2008-07-23 CN disclosed
EP-1921074-A1 THIAZOLE DERIVATIVE Astellas Pharma Inc. (JP) 2008-05-14 EP 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-20090281142-A1 THIAZOLE DERIVATIVE GK, GCKR, AK2 CYP1A2 2841/4885CYP2C19 3703/4885MAPK1 3320/4885

“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.