SCHEMBL6967361

SCHEMBL6967361

Cc1cc(N2CCN(C(=O)N3CCN(S(=O)(=O)c4ccc(Br)cc4)CC3)CC2)ncn1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LSS P48449 3/20 0.53
KDM4E B2RXH2 1/20 0.51
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
NOD2 Q9HC29 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.47
GPR183 P32249 2/20 0.46
MAPT P10636 2/20 0.45
LMNA P02545 1/20 0.45
APAF1 O14727 1/20 0.44
GAA P10253 1/20 0.44
HPGD P15428 1/20 0.44

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
SCHEMBL6975703 0.87 LSS (0.53) LSSKDM4EMEN1KMT2ANOD2
SCHEMBL7654951 0.87 LSS (0.72) LSSSMN1; SMN2MAPTLMNA
SCHEMBL6977047 0.86 LSS (0.51) LSSKDM4EMEN1KMT2ANOD2
SCHEMBL9729927 0.84 MEN1 (0.60) KDM4EMEN1KMT2ASMN1; SMN2MAPT
SCHEMBL6980904 0.83 LSS (0.68) LSSHPGD
SCHEMBL6977387 0.80 LSS (0.76) LSSKDM4EMEN1KMT2ANOD2
SCHEMBL7660934 0.80 LSS (0.48) LSSKDM4EMEN1KMT2ANOD2
SCHEMBL6978604 0.77 LSS (0.71) LSSKDM4EMEN1KMT2ASMN1; SMN2
SCHEMBL6980850 0.76 LSS (0.61) LSSMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL7446074 0.75 LSS (0.73) LSSSMN1; SMN2GPR183LMNA

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 6 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 claimed
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 claimed
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