SCHEMBL6923841

SCHEMBL6923841

Nn1c(C2CCCCC2)cc(-n2cccn2)cc1=O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KAT7 O95251 1/20 0.35
LMNA P02545 3/20 0.34
RAB9A P51151 1/20 0.34
CHRM1 P11229 2/20 0.34
NR1I2 O75469 1/20 0.34
KDM4B O94953 1/20 0.34
TBXA2R P21731 1/20 0.34
ADRA1A P35348 1/20 0.34
DOHH Q9BU89 1/20 0.34
CHEK2 O96017 1/20 0.34
KDM4E B2RXH2 2/20 0.33
MAPK1 P28482 2/20 0.33
HCRTR1 O43613 2/20 0.33
HCRTR2 O43614 2/20 0.33
ALDH1A1 P00352 1/20 0.33
ATM Q13315 1/20 0.33
ADORA2A P29274 1/20 0.33
NOTUM Q6P988 1/20 0.33
PDE2A O00408 2/20 0.32
HRH3 Q9Y5N1 1/20 0.32

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
SCHEMBL6827260 0.82 NOTUM (0.38) KAT7LMNACHRM1NR1I2KDM4B
SCHEMBL6827158 0.79 KDM4E (0.34) LMNACHRM1NR1I2KDM4BTBXA2R
SCHEMBL6827359 0.76 PGR (0.38) LMNACHRM1NR1I2KDM4BTBXA2R
SCHEMBL6824827 0.76 PGR (0.38) LMNACHRM1NR1I2KDM4BTBXA2R
SCHEMBL6827087 0.75 PGR (0.39) LMNAPDE2A
SCHEMBL6923814 0.74 NR1I2 (0.38) LMNACHRM1NR1I2KDM4BTBXA2R
SCHEMBL6924372 0.72 LMNA (0.41) KAT7LMNARAB9ACHRM1CHEK2
SCHEMBL6919738 0.72 PDE4A (0.36) LMNACHRM1NR1I2KDM4BTBXA2R
SCHEMBL6919295 0.70 NR1I2 (0.42) LMNACHRM1NR1I2KDM4BTBXA2R
SCHEMBL6827816 0.69 HTT (0.43) KDM4EALDH1A1ATMTP53

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004050624-A1 SUBSTITUTED 1H-PYRIDINE-2-ONE DERIVATIVES C & C RESEARCH LABORATORIES (KR) 2004-06-17 WO claimed
WO-2004050624-A1 SUBSTITUTED 1H-PYRIDINE-2-ONE DERIVATIVES C & C RESEARCH LABORATORIES (KR) 2004-06-17 WO disclosed