SCHEMBL6589904

SCHEMBL6589904

Cc1cc(C)cc(C2=NC(c3ccccc3)(c3ccccc3)C(=O)N2)c1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 16/20 0.53
BACE2 Q9Y5Z0 8/20 0.53
LMNA P02545 1/20 0.53
GLA P06280 1/20 0.53
THRB P10828 1/20 0.53
CYP2C9 P11712 1/20 0.53
BLM P54132 1/20 0.53
PMP22 Q01453 1/20 0.53
KMT2A Q03164 1/20 0.53
APP P05067 2/20 0.41
REN P00797 1/20 0.41
MMP2 P08253 1/20 0.37
MMP9 P14780 1/20 0.37
CTSD P07339 3/20 0.37
ALDH1A1 P00352 1/20 0.36

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
SCHEMBL6593802 0.89 BACE1 (0.49) BACE1BACE2LMNAGLATHRB
SCHEMBL6591928 0.84 BACE1 (0.61) BACE1BACE2LMNAGLATHRB
SCHEMBL2980975 0.77 BACE1 (0.61) BACE1BACE2LMNAGLATHRB
SCHEMBL6589473 0.77 BACE1 (0.53) BACE1BACE2LMNAGLATHRB
SCHEMBL6591279 0.77 BACE1 (0.53) BACE1BACE2LMNAGLATHRB
SCHEMBL6600448 0.76 BACE1 (0.49) BACE1BACE2LMNAGLATHRB
SCHEMBL6591931 0.76 BACE1 (0.49) BACE1BACE2LMNAGLATHRB
SCHEMBL6587931 0.76 BACE1 (0.49) BACE1BACE2LMNAGLATHRB
SCHEMBL6593173 0.76 KMT2A (0.49) BACE1BACE2LMNAGLATHRB
SCHEMBL6588437 0.74 BACE1 (0.50) BACE1BACE2LMNAGLATHRB

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-1066279-A4 IMIDAZOLONE ANORECTIC AGENTS: II. PHENYL DERIVATIVES BRISTOL MYERS SQUIBB CO (US) 2004-09-08 EP disclosed
EP-1066279-A1 IMIDAZOLONE ANORECTIC AGENTS: II. PHENYL DERIVATIVES Bristol-Myers Squibb Company (US) 2001-01-10 EP disclosed
US-6054590-A NEUROPEPTIDE Y (NPY) ANTAGONISTS FOR TREATMENT OF EATING DISORDERS AND PROMOTING WEIGHT LOSS BRISTOL-MYERS SQUIBB COMPANY (US) 2000-04-25 US disclosed
WO-1999048888-A1 IMIDAZOLONE ANORECTIC AGENTS: II. PHENYL DERIVATIVES BRISTOL-MYERS SQUIBB COMPANY (US) 1999-09-30 WO disclosed