SCHEMBL4363340

SCHEMBL4363340

O=C1N=C(N2CCOCC2)S/C1=C\c1cccc(O)c1

nearest known ligand 0.67

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.67
KMT2A Q03164 5/20 0.67
MEN1 O00255 4/20 0.67
SMN1; SMN2 Q16637 3/20 0.67
HPGD P15428 2/20 0.67
CYP1A2 P05177 2/20 0.61
CYP2C19 P33261 2/20 0.61
MAPT P10636 6/20 0.60
HTT P42858 1/20 0.60
RAB9A P51151 3/20 0.58
NPC1 O15118 2/20 0.58
DCTPP1 Q9H773 1/20 0.58
HCRTR1 O43613 1/20 0.58
KDM4E B2RXH2 1/20 0.58
GAA P10253 1/20 0.58
NPSR1 Q6W5P4 1/20 0.55
GRIN1 Q05586 2/20 0.54
GRIN2B Q13224 2/20 0.54

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
SCHEMBL4363345 1.00 ALDH1A1 (0.67) ALDH1A1KMT2AMEN1SMN1; SMN2HPGD
SCHEMBL3426669 0.88 KMT2A (0.72) ALDH1A1KMT2AMEN1SMN1; SMN2HPGD
SCHEMBL3426671 0.88 KMT2A (0.72) ALDH1A1KMT2AMEN1SMN1; SMN2HPGD
SCHEMBL4352381 0.85 DCTPP1 (0.74) ALDH1A1KMT2AMEN1SMN1; SMN2HPGD
SCHEMBL4352377 0.85 DCTPP1 (0.74) ALDH1A1KMT2AMEN1SMN1; SMN2HPGD
SCHEMBL4354258 0.85 ALDH1A1 (0.78) ALDH1A1KMT2AMEN1SMN1; SMN2HPGD
SCHEMBL4354253 0.85 ALDH1A1 (0.78) ALDH1A1KMT2AMEN1SMN1; SMN2HPGD
SCHEMBL4350550 0.84 KMT2A (0.62) ALDH1A1KMT2AMEN1SMN1; SMN2HPGD
SCHEMBL4350546 0.84 KMT2A (0.62) ALDH1A1KMT2AMEN1SMN1; SMN2HPGD
Bromide SCHEMBL4352446 0.84 ALDH1A1 (0.76) ALDH1A1KMT2AMEN1SMN1; SMN2HPGD

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-1890695-B1 USE OF 2,5-DISUBSTITUTED THIAZOL-4-ONE DERIVATIVES IN DRUGS GRUENENTHAL GMBH (DE) 2013-02-20 EP claimed
US-20090215758-A1 Use of 2,5-Disubstituted Thiazol-4-One Derivatives in Drugs GRUENENTHAL GMBH (DE) 2009-08-27 US claimed
US-20090215758-A1 Use of 2,5-Disubstituted Thiazol-4-One Derivatives in Drugs GRUENENTHAL GMBH (DE) 2009-08-27 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-20090215758-A1 Use of 2,5-Disubstituted Thiazol-4-One Derivatives in Drugs ABCB1, ABCG2, SLC5A2 ALDH1A1 284/4885KMT2A 3923/4885MEN1 1725/4885

“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.