SCHEMBL19928751

SCHEMBL19928751

NC(=O)c1ccc2c(n1)NCC2

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NNMT P40261 5/20 0.49
PIM1 P11309 1/20 0.38
MAP3K14 Q99558 1/20 0.35
ITGB3 P05106 2/20 0.34
ITGAV P06756 2/20 0.34
LMNA P02545 1/20 0.33
CXCR4 P61073 3/20 0.33
PIK3C3 Q8NEB9 1/20 0.33
ADORA3 P0DMS8 1/20 0.32
TSHR P16473 1/20 0.32
MC4R P32245 1/20 0.32
ADRA1A P35348 1/20 0.32
MC3R P41968 1/20 0.32
ITGA2B P08514 1/20 0.32
SCN9A Q15858 1/20 0.32
ASIC3 Q9UHC3 1/20 0.32
KMT2A Q03164 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
SCHEMBL30104081 0.86 KDM4E (0.41) NNMTITGB3ITGAVLMNATSHR
SCHEMBL14610720 0.76 ITGB3 (0.46) NNMTITGB3ITGAVCXCR4ITGA2B
SCHEMBL13995820 0.75 ITGB3 (0.45) ITGB3ITGAVCXCR4ITGA2B
SCHEMBL17541073 0.72 HTR2C (0.41)
SCHEMBL30540616 0.71 PIM1 (0.38) NNMTPIM1MAP3K14LMNAADORA3
SCHEMBL16135650 0.70 NNMT (0.53) NNMTPIK3C3ASIC3
SCHEMBL23093250 0.69 PARP10 (0.38) NNMTASIC3
SCHEMBL279310 0.69 UHRF1 (0.43) NNMTASIC3
SCHEMBL21273854 0.69 F7 (0.38) NNMTPIM1ASIC3
SCHEMBL16496259 0.69 PIM1 (0.42) NNMTPIM1MAP3K14LMNAADORA3

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
EP-3507289-A1 MUSCARINIC M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS Suven Life Sciences Limited (IN) 2019-07-10 EP disclosed
WO-2018042362-A1 MUSCARINIC M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS SUVEN LIFE SCIENCES LIMITED (IN) 2018-03-08 WO disclosed