SCHEMBL4354179

SCHEMBL4354179

Cc1ccc(N2CCN(C3=NC(=O)C(=CC=Cc4ccccc4)S3)CC2)nn1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.69
RAB9A P51151 4/20 0.69
NPC1 O15118 4/20 0.69
KMT2A Q03164 6/20 0.65
MEN1 O00255 5/20 0.65
CYP1A2 P05177 1/20 0.65
CYP2C19 P33261 1/20 0.65
ALDH1A1 P00352 6/20 0.49
ALOX5 P09917 1/20 0.48
SMN1; SMN2 Q16637 3/20 0.44
HCRTR1 O43613 1/20 0.44
DCTPP1 Q9H773 1/20 0.43
L3MBTL1 Q9Y468 4/20 0.42
HPGD P15428 3/20 0.42
LMNA P02545 2/20 0.41
SENP1 Q9P0U3 1/20 0.41
POLB P06746 3/20 0.41
GAA P10253 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
GRIN1 Q05586 2/20 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
SCHEMBL4350832 0.88 MAPT (0.54) MAPTRAB9ANPC1KMT2AMEN1
SCHEMBL4356154 0.82 MAPT (0.81) MAPTRAB9ANPC1KMT2AMEN1
SCHEMBL4351680 0.82 MAPT (1.00) MAPTRAB9ANPC1KMT2AMEN1
Bromide SCHEMBL4357188 0.81 MAPT (0.97) MAPTRAB9ANPC1KMT2AMEN1
SCHEMBL4350276 0.81 NPC1 (0.97) MAPTRAB9ANPC1KMT2AMEN1
SCHEMBL4359202 0.81 NPC1 (0.97) MAPTRAB9ANPC1KMT2AMEN1
Bromide SCHEMBL4359793 0.80 NPC1 (0.95) MAPTRAB9ANPC1KMT2AMEN1
Bromide SCHEMBL4354152 0.80 NPC1 (0.95) MAPTRAB9ANPC1KMT2AMEN1
SCHEMBL4359181 0.80 MAPT (0.81) MAPTRAB9ANPC1KMT2AMEN1
SCHEMBL4359184 0.79 MAPT (0.69) MAPTRAB9ANPC1KMT2AMEN1

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 8 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
EP-1890695-A2 USE OF 2,5-DISUBSTITUTED THIAZOL-4-ONE DERIVATIVES IN DRUGS Grünenthal GmbH (DE) 2008-02-27 EP claimed
WO-2006122777-A2 USE OF 2,5-DISUBSTITUTED THIAZOL-4-ONE DERIVATIVES IN DRUGS Grünenthal GmbH (DE) 2006-11-23 WO claimed
EP-1890695-B1 USE OF 2,5-DISUBSTITUTED THIAZOL-4-ONE DERIVATIVES IN DRUGS GRUENENTHAL GMBH (DE) 2013-02-20 EP disclosed
US-20090215758-A1 Use of 2,5-Disubstituted Thiazol-4-One Derivatives in Drugs GRUENENTHAL GMBH (DE) 2009-08-27 US disclosed
EP-1890695-A2 USE OF 2,5-DISUBSTITUTED THIAZOL-4-ONE DERIVATIVES IN DRUGS Grünenthal GmbH (DE) 2008-02-27 EP disclosed
WO-2006122777-A2 USE OF 2,5-DISUBSTITUTED THIAZOL-4-ONE DERIVATIVES IN DRUGS Grünenthal GmbH (DE) 2006-11-23 WO 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 MAPT 1470/4885RAB9A 3151/4885NPC1 326/4885

“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.