SCHEMBL7556356

SCHEMBL7556356

OC(c1ncccc1-c1ccccc1)c1ncccc1-c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.41
HSD17B10 Q99714 3/20 0.41
HPGD P15428 1/20 0.41
BCL2L1 Q07817 1/20 0.41
LMNA P02545 2/20 0.41
TOP1 P11387 1/20 0.41
HTT P42858 2/20 0.40
CHRNB2 P17787 1/20 0.40
CHRNB4 P30926 1/20 0.40
CHRNA3 P32297 1/20 0.40
CHRNA4 P43681 1/20 0.40
PTGS1 P23219 1/20 0.40
PTGS2 P35354 1/20 0.40
PTPRC P08575 2/20 0.39
CTSL P07711 1/20 0.39
CTSS P25774 1/20 0.39
PTPN13 Q12923 1/20 0.39
PDK2 Q15119 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
BACE1 P56817 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
SCHEMBL7559743 0.86 PDK2 (0.42) ALDH1A1HSD17B10HPGDBCL2L1TOP1
SCHEMBL7552809 0.85 TDP1 (0.43) ALDH1A1HSD17B10HPGDLMNASMN1; SMN2
SCHEMBL15723950 0.83 PTGS1 (0.44) ALDH1A1HSD17B10HPGDBCL2L1TOP1
SCHEMBL2799553 0.82 TOP1 (0.35) ALDH1A1HSD17B10HPGDBCL2L1LMNA
SCHEMBL7558423 0.81 KDM4E (0.44) ALDH1A1HSD17B10HPGDSMN1; SMN2MAPK1
SCHEMBL14555509 0.80 PTGS2 (0.45) ALDH1A1HSD17B10HPGDLMNATOP1
SCHEMBL2027276 0.78 PTGS2 (0.47) HPGDLMNACHRNB2CHRNB4CHRNA3
SCHEMBL27658148 0.77 PTGS1 (0.40) ALDH1A1HSD17B10LMNATOP1HTT
SCHEMBL15723954 0.76 PTGS2 (0.41) ALDH1A1HSD17B10TOP1HTTCHRNB2
SCHEMBL20466883 0.76 PTGS1 (0.39) ALDH1A1HSD17B10HPGDLMNATOP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1036081-B1 HETEROCYCLYL LIGAND CONTAINING RUTHENIUM AND OSMIUM CATALYSTS CIBA SC HOLDING AG (CH) 2002-07-17 EP disclosed
US-6417363-B1 POLYMERIZATION, RING-CLOSURE METATHESIS, OLIGOMERIZATION, AND CYCLIZATION CATALYSTS CIBA SPECIALTY CHEMICALS CORPORATION 2002-07-09 US disclosed
EP-1036081-A1 HETEROCYCLYL LIGAND CONTAINING RUTHENIUM AND OSMIUM CATALYSTS Ciba SC Holding AG (CH) 2000-09-20 EP disclosed
WO-1999029701-A1 HETEROCYCLYL LIGAND CONTAINING RUTHENIUM AND OSMIUM CATALYSTS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 1999-06-17 WO disclosed