SCHEMBL7552809

SCHEMBL7552809

OC(c1ncccc1-c1ccc(Cl)cc1)c1ncccc1-c1ccc(Cl)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.43
DHODH Q02127 3/20 0.40
RAB9A P51151 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
ANO1 Q5XXA6 1/20 0.39
CYP1A2 P05177 1/20 0.39
HPGD P15428 1/20 0.39
MAP4K4 O95819 1/20 0.38
LMNA P02545 1/20 0.38
BRS3 P32247 1/20 0.37
GLO1 Q04760 1/20 0.37
NPC1 O15118 2/20 0.37
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
TP53 P04637 1/20 0.37
TSHR P16473 1/20 0.37
NFKB1 P19838 1/20 0.37
CASP3 P42574 1/20 0.37

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
SCHEMBL7556356 0.85 ALDH1A1 (0.41) SMN1; SMN2HPGDLMNAALDH1A1TSHR
SCHEMBL18853955 0.84 TDP1 (0.41) TDP1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL9658555 0.79 ADRB2 (0.41) TDP1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL7558423 0.78 KDM4E (0.44) TDP1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL8855211 0.76 TDP1 (0.47) TDP1RAB9AMEN1KMT2ACYP1A2
SCHEMBL5516950 0.74 ALDH1A1 (0.52) TDP1RAB9AKMT2AGLO1NPC1
SCHEMBL28279884 0.73 PTGS2 (0.51) TDP1DHODHRAB9ASMN1; SMN2MEN1
SCHEMBL24534409 0.73 PTGS2 (0.59) TDP1DHODHCYP1A2MAP4K4LMNA
SCHEMBL7559743 0.73 PDK2 (0.42) DHODHHPGDALDH1A1HSD17B10MKNK1
SCHEMBL20371666 0.72 MKNK1 (0.57) TDP1DHODHRAB9AMEN1KMT2A

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