SCHEMBL6599494

SCHEMBL6599494

N#Cc1ccc(C2=NC(c3ccccc3)(c3ccccc3)C(=O)N2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 3/20 0.49
KMT2A Q03164 2/20 0.49
BACE2 Q9Y5Z0 1/20 0.49
LMNA P02545 1/20 0.49
GLA P06280 1/20 0.49
THRB P10828 1/20 0.49
CYP2C9 P11712 1/20 0.49
BLM P54132 1/20 0.49
PMP22 Q01453 1/20 0.49
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
TSHR P16473 1/20 0.38
MEN1 O00255 1/20 0.38
ATM Q13315 1/20 0.38
IDO1 P14902 1/20 0.38
NOTUM Q6P988 1/20 0.38
MAOB P27338 2/20 0.37
OPRM1 P35372 2/20 0.36
OPRL1 P41146 2/20 0.36
GABRA1 P14867 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
SCHEMBL6590780 0.84 BACE1 (0.49) BACE1KMT2ABACE2LMNAGLA
SCHEMBL6591928 0.84 BACE1 (0.61) BACE1KMT2ABACE2LMNAGLA
SCHEMBL6589473 0.80 BACE1 (0.53) BACE1KMT2ABACE2LMNAGLA
SCHEMBL6584810 0.78 BACE1 (0.54) BACE1KMT2ABACE2LMNAGLA
SCHEMBL6590512 0.76 BACE1 (0.49) BACE1KMT2ABACE2LMNAGLA
SCHEMBL6591279 0.73 BACE1 (0.53) BACE1KMT2ABACE2LMNAGLA
SCHEMBL6589904 0.73 BACE1 (0.53) BACE1KMT2ABACE2LMNAGLA
SCHEMBL6588437 0.71 BACE1 (0.50) BACE1KMT2ABACE2LMNAGLA
SCHEMBL8183941 0.71 BACE1 (0.58) BACE1KMT2ABACE2LMNAGLA
SCHEMBL6591931 0.70 BACE1 (0.49) BACE1KMT2ABACE2LMNAGLA

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