SCHEMBL6981493

SCHEMBL6981493

Cc1nccc(N2CCC(C)(C(=O)N3CCN(S(=O)(=O)c4ccc(Br)cc4)CC3)CC2)n1

nearest known ligand 0.69

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LSS P48449 3/20 0.69
GBA1 P04062 1/20 0.41
GPR183 P32249 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
KDM4E B2RXH2 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
MAPT P10636 2/20 0.39
LMNA P02545 1/20 0.39

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
SCHEMBL7658217 0.96 LSS (0.66) LSSGBA1GPR183SMN1; SMN2KDM4E
SCHEMBL8310420 0.88 LSS (0.66) LSSGBA1GPR183SMN1; SMN2MAPT
SCHEMBL6969184 0.88 LSS (0.54) LSSGBA1GPR183MAPTLMNA
SCHEMBL6980618 0.87 LSS (0.65) LSSGBA1GPR183SMN1; SMN2KDM4E
SCHEMBL6977387 0.86 LSS (0.76) LSSGBA1GPR183SMN1; SMN2KDM4E
SCHEMBL6981290 0.85 LSS (0.67) LSSGPR183SMN1; SMN2KDM4EMAPT
SCHEMBL6978604 0.82 LSS (0.71) LSSGBA1SMN1; SMN2KDM4EMEN1
SCHEMBL6182258 0.82 LSS (1.00) LSSLMNA
SCHEMBL6979382 0.81 LSS (0.48) LSSGBA1GPR183KDM4EMEN1
SCHEMBL6977537 0.80 LSS (0.93) LSSSMN1; SMN2KDM4EMAPTLMNA

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-0925286-B1 SUBSTITUTED PYRIMIDINE DERIVATIVES AND THEIR PHARMACEUTICAL USE ASTRAZENECA AB (SE) 2003-01-02 EP disclosed
US-6093718-A AN OXIDO-SQUALENE CYCLASE INHIBITOR, ANTICHOLESTEROL AGENT FOR INHIBITING CHOLESTEROL BIOSYNTHESIS AND LOWERING CHOLESTEROL LEVELS IN BLOOD PLASMA; TREATING HYPERCHOLESTEROLEMIA AND ATHEROSCLEROSIS ZENECA LIMITED (GB) 2000-07-25 US disclosed
EP-0925286-A1 SUBSTITUTED PYRIMIDINE DERIVATIVES AND THEIR PHARMACEUTICAL USE ZENECA LIMITED (GB) 1999-06-30 EP disclosed
WO-1998006705-A1 SUBSTITUTED PYRIMIDINE DERIVATIVES AND THEIR PHARMACEUTICAL USE ZENECA LIMITED (GB) 1998-02-19 WO disclosed