SCHEMBL6312005

SCHEMBL6312005

CC(C)c1nc2ccccc2nc1Cl

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.58
GAA P10253 1/20 0.46
KDM4E B2RXH2 3/20 0.45
PKM P14618 1/20 0.45
L3MBTL1 Q9Y468 3/20 0.44
NPSR1 Q6W5P4 2/20 0.43
MAPT P10636 1/20 0.42
ALDH1A1 P00352 3/20 0.41
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
HPGD P15428 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HTR3B O95264 1/20 0.41
HTR3A P46098 1/20 0.41
HRH4 Q9H3N8 1/20 0.41
RXFP1 Q9HBX9 2/20 0.40
PDE4B Q07343 2/20 0.39
FABP3 P05413 1/20 0.38
FABP4 P15090 1/20 0.38
FABP5 Q01469 1/20 0.38

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
SCHEMBL13150847 0.84 MAPT (0.53) TDP1GAAKDM4EL3MBTL1MAPT
SCHEMBL4174147 0.79 TDP1 (0.39) TDP1GAAPKMMAPTALDH1A1
SCHEMBL20049121 0.79 NPC1 (0.40) TDP1GAAKDM4EL3MBTL1MAPT
SCHEMBL20049288 0.79 ALDH1A1 (0.50) TDP1GAAKDM4EL3MBTL1NPSR1
SCHEMBL4173884 0.79 NR4A2 (0.39) TDP1GAAPKMMAPTALDH1A1
SCHEMBL19535296 0.78 TDP1 (0.58) TDP1GAAKDM4EPKML3MBTL1
SCHEMBL29589829 0.78 TDP1 (0.58) TDP1GAAKDM4EPKML3MBTL1
SCHEMBL6305823 0.78 GLP1R (0.58) GLP1R
SCHEMBL9901079 0.77 GLP1R (0.36) TDP1GLP1R
SCHEMBL11327423 0.76 MAPT (0.47) TDP1GAAKDM4EL3MBTL1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022073469-A1 COMPOUNDS AND METHODS OF TREATING CANCERS CULLGEN (SHANGHAI) , INC. (CN) 2022-04-14 WO disclosed
US-10889611-B2 Sialyltransferase inhibitors and uses thereof ACADEMIA SINICA (TW) 2021-01-12 US disclosed
US-20110081315-A1 NOVEL MACROCYCLIC INHIBITORS OF HEPATITIS C VIRUS REPLICATION INTERMUNE, INC. (US) 2011-04-07 US disclosed
US-20110081315-A1 NOVEL MACROCYCLIC INHIBITORS OF HEPATITIS C VIRUS REPLICATION INTERMUNE, INC. (US) 2011-04-07 US disclosed
US-6927214-B1 Non-peptide GLP-1 agonists NOVO NORDISK A/S (DK) 2005-08-09 US disclosed
EP-1147094-A1 NON-PEPTIDE GLP-1 AGONISTS NOVO NORDISK A/S (DK) 2001-10-24 EP disclosed
WO-2000042026-A1 NON-PEPTIDE GLP-1 AGONISTS NOVO NORDISK A/S (DK) 2000-07-20 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 (2 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-10889611-B2 Sialyltransferase inhibitors and uses thereof ST6GAL1, NEU1, GALNT1 TDP1 973/4885GAA 194/4885KDM4E 4044/4885
US-20110081315-A1 NOVEL MACROCYCLIC INHIBITORS OF HEPATITIS C VIRUS REPLICATION EIF2AK2, HAVCR2, EIF4A2 TDP1 4116/4885GAA 1078/4885KDM4E 457/4885

“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.