SCHEMBL7477152

SCHEMBL7477152

CCNc1nsc2nc3ccccc3n12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.40
HSD17B10 Q99714 3/20 0.40
POLB P06746 1/20 0.40
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
RXFP1 Q9HBX9 1/20 0.39
RAD51 Q06609 1/20 0.39
SMN1; SMN2 Q16637 5/20 0.39
LMNA P02545 3/20 0.39
RAB9A P51151 2/20 0.39
NPC1 O15118 1/20 0.39
ALDH1A1 P00352 4/20 0.38
MAPT P10636 4/20 0.38
HPGD P15428 4/20 0.38
MAPK1 P28482 2/20 0.38
USP2 O75604 1/20 0.38
TSHR P16473 1/20 0.38
HTR2C P28335 1/20 0.38
ALOX15 P16050 2/20 0.38
APOBEC3G Q9HC16 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
SCHEMBL7482369 0.83 HSD17B10 (0.43) KDM4EHSD17B10POLBMEN1KMT2A
SCHEMBL7473547 0.79 ALDH1A1 (0.58) KDM4EHSD17B10MEN1KMT2ASMN1; SMN2
SCHEMBL7481507 0.78 KDM4E (0.53) KDM4EHSD17B10MEN1KMT2ASMN1; SMN2
SCHEMBL8558765 0.75 ALDH1A1 (0.36) KDM4EMEN1KMT2ARXFP1SMN1; SMN2
SCHEMBL8044732 0.75 KDM4E (0.52) KDM4EHSD17B10POLBMEN1KMT2A
SCHEMBL8044065 0.74 HSD17B10 (0.47) KDM4EHSD17B10POLBMEN1KMT2A
SCHEMBL7476136 0.74 KMT2A (0.41) KDM4EHSD17B10POLBMEN1KMT2A
SCHEMBL7473993 0.73 ADORA3 (0.41) KDM4EHSD17B10MEN1KMT2ARXFP1
SCHEMBL12136194 0.73 RAB9A (0.68) KDM4EHSD17B10POLBMEN1KMT2A
SCHEMBL7484099 0.72 ADORA3 (0.43) KDM4EHSD17B10POLBMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0883622-B1 PROTON PUMP INHIBITOR APOTEX INC (CA) 2002-05-15 EP disclosed
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
US-5677302-A Thiadiazole compounds useful as proton pump inhibitors APOTEX INC. (CA) 1997-10-14 US disclosed