SCHEMBL8747808

SCHEMBL8747808

CCCCCCCc1cnc(-c2cc[c]cc2)nc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 5/20 0.62
RAB9A P51151 6/20 0.59
SMN1; SMN2 Q16637 4/20 0.59
MAPT P10636 4/20 0.59
HSD17B10 Q99714 4/20 0.59
KDM4E B2RXH2 3/20 0.59
ALDH1A1 P00352 3/20 0.59
MEN1 O00255 2/20 0.59
KMT2A Q03164 2/20 0.59
USP2 O75604 1/20 0.59
GAA P10253 1/20 0.59
HPGD P15428 1/20 0.59
NPC1 O15118 4/20 0.46
STAT3 P40763 1/20 0.46
ATM Q13315 1/20 0.46
NFKB1 P19838 1/20 0.43
NFKB2 Q00653 1/20 0.43
RELA Q04206 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.41
CASP3 P42574 1/20 0.41

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
SCHEMBL5888400 1.00 RARB (0.62) RARBRAB9ASMN1; SMN2MAPTHSD17B10
SCHEMBL8075234 1.00 RARB (0.62) RARBRAB9ASMN1; SMN2MAPTHSD17B10
SCHEMBL9272426 1.00 RARB (0.62) RARBRAB9ASMN1; SMN2MAPTHSD17B10
SCHEMBL8631186 1.00 RARB (0.62) RARBRAB9ASMN1; SMN2MAPTHSD17B10
SCHEMBL8918716 1.00 RARB (0.62) RARBRAB9ASMN1; SMN2MAPTHSD17B10
SCHEMBL8713869 1.00 RARB (0.62) RARBRAB9ASMN1; SMN2MAPTHSD17B10
SCHEMBL7723530 0.98 RARB (0.60) RARBRAB9ASMN1; SMN2MAPTHSD17B10
SCHEMBL10793104 0.93 RARB (0.54) RARBRAB9ASMN1; SMN2MAPTHSD17B10
SCHEMBL8917053 0.88 MAPT (0.65) RARBRAB9ASMN1; SMN2MAPTHSD17B10
SCHEMBL7677484 0.88 MAPT (0.65) RARBRAB9ASMN1; SMN2MAPTHSD17B10

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
EP-0520281-B1 Optical element for generating short wave laser light HOFFMANN LA ROCHE (CH) 1997-03-12 EP disclosed
US-5393458-A Aromatic esters and liquid crystal mixtures containing same HOFFMANN-LA ROCHE INC. (US) 1995-02-28 US disclosed
US-5326498-A Electrooptics, ferroelectricity HOFFMANN-LA ROCHE INC. (US) 1994-07-05 US disclosed
US-5180521-A Liquid crystal displays, cyclohexyl nitriles MERCK PATENT GESELLSCHAFT MIT BESCHRAENKTER HAFTUNG (DE) 1993-01-19 US disclosed
EP-0520281-A2 Optical element for generating short wave laser light F. HOFFMANN-LA ROCHE AG (CH) 1992-12-30 EP disclosed
CN-1032435-A The phenyl trifluoromethyl ethers that replaces MERCK PATENT GMBH (DE) 1989-04-19 CN disclosed
EP-0220297-A1 NITROGEN-CONTAINING HETEROCYCLES. MERCK PATENT GMBH (DE) 1987-05-06 EP disclosed
WO-1986006373-A1 NITROGEN-CONTAINING HETEROCYCLES MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 1986-11-06 WO disclosed