SCHEMBL6593173

SCHEMBL6593173

O=C1NC(c2cccc(Br)c2)=NC1(c1ccccc1)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.49
BACE1 P56817 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
IDO1 P14902 2/20 0.43
NPC1 O15118 3/20 0.41
RAB9A P51151 3/20 0.41
TSHR P16473 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
TP53 P04637 1/20 0.41
ALDH1A1 P00352 3/20 0.40
HPGD P15428 3/20 0.40
MEN1 O00255 2/20 0.40
NPY5R Q15761 1/20 0.40
MAPT P10636 1/20 0.40

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
SCHEMBL6591928 0.84 BACE1 (0.61) KMT2ABACE1BACE2LMNAGLA
SCHEMBL8183941 0.83 BACE1 (0.58) KMT2ABACE1BACE2LMNAGLA
SCHEMBL6587931 0.82 BACE1 (0.49) KMT2ABACE1BACE2LMNAGLA
SCHEMBL6591931 0.82 BACE1 (0.49) KMT2ABACE1BACE2LMNAGLA
SCHEMBL6593802 0.82 BACE1 (0.49) KMT2ABACE1BACE2LMNAGLA
SCHEMBL6600448 0.82 BACE1 (0.49) KMT2ABACE1BACE2LMNAGLA
SCHEMBL6595107 0.79 KMT2A (0.46) KMT2ABACE1BACE2LMNAGLA
SCHEMBL6590780 0.78 BACE1 (0.49) KMT2ABACE1BACE2LMNAGLA
SCHEMBL6590716 0.78 LMNA (0.45) KMT2ABACE1BACE2LMNAGLA
SCHEMBL8182638 0.78 BACE1 (0.45) KMT2ABACE1BACE2LMNAGLA

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