SCHEMBL8044065

SCHEMBL8044065

Cc1nsc2nc3ccccc3n12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 4/20 0.47
POLB P06746 4/20 0.47
MAPT P10636 4/20 0.47
KDM4E B2RXH2 3/20 0.47
TP53 P04637 3/20 0.47
LMNA P02545 3/20 0.47
MAPK1 P28482 2/20 0.47
HTT P42858 1/20 0.47
KMT2A Q03164 4/20 0.43
MEN1 O00255 3/20 0.43
ALDH1A1 P00352 4/20 0.41
SMN1; SMN2 Q16637 4/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
TSHR P16473 2/20 0.41
HPGD P15428 3/20 0.41
RXFP1 Q9HBX9 1/20 0.40
HIF1A Q16665 1/20 0.40
ENPP1 P22413 1/20 0.40
CSNK1A1 P48729 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
SCHEMBL7477004 0.79 KDM4E (0.51) HSD17B10POLBMAPTKDM4ETP53
SCHEMBL7481507 0.79 KDM4E (0.53) HSD17B10MAPTKDM4EMAPK1KMT2A
SCHEMBL7470768 0.79 KDM4E (0.46) HSD17B10POLBMAPTKDM4ETP53
SCHEMBL7475534 0.79 SMN1; SMN2 (0.47) HSD17B10POLBMAPTKDM4ETP53
SCHEMBL7474031 0.79 DYRK1A (0.51) HSD17B10POLBKDM4ETP53LMNA
SCHEMBL7007238 0.79 KDM4E (0.46) HSD17B10POLBMAPTKDM4ETP53
SCHEMBL7478966 0.78 HSD17B10 (0.43) HSD17B10POLBMAPTKDM4ETP53
SCHEMBL7482369 0.78 HSD17B10 (0.43) HSD17B10POLBMAPTKDM4ETP53
SCHEMBL7476293 0.78 HSD17B10 (0.43) HSD17B10POLBMAPTKDM4ETP53
SCHEMBL7474625 0.78 HSD17B10 (0.46) HSD17B10POLBMAPTKDM4ETP53

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
US-6114537-A 1,2,4-THIADIAZOLE COMPOUND IS USEFUL FOR TRAPPING THIOL COMPOUNDS AND SELECTIVELY CHANGING THIOLS TO DISULFIDE COMPOUNDS APOTEX INC. (CA) 2000-09-05 US disclosed
US-6093738-A IMIDAZO(1,2-D)-THIADIAZOLE COMPOUNDS; PEPTIC ULCER TREATMENT KARIMIAN KHASHAYAR (CA) 2000-07-25 US disclosed
CN-1216527-A Method for scavenging mercaptan APOTEX INC (CA) 1999-05-12 CN disclosed
EP-0883622-A1 PROTON PUMP INHIBITOR APOTEX INC. (CA) 1998-12-16 EP disclosed
EP-0883606-A1 PROCESS FOR SCAVENGING THIOLS APOTEX INC. (CA) 1998-12-16 EP disclosed
US-5677302-A Thiadiazole compounds useful as proton pump inhibitors APOTEX INC. (CA) 1997-10-14 US disclosed
WO-1997031923-A1 PROTON PUMP INHIBITOR APOTEX INC. (CA) 1997-09-04 WO disclosed
WO-1997031893-A1 PROCESS FOR SCAVENGING THIOLS APOTEX INC. (CA) 1997-09-04 WO disclosed