SCHEMBL6920616

SCHEMBL6920616

O=c1cc(-n2ccnc2)cc(C2CCCCC2)[nH]1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGR P06401 1/20 0.41
YTHDF3 Q7Z739 1/20 0.41
YTHDF1 Q9BYJ9 1/20 0.41
YTHDF2 Q9Y5A9 1/20 0.41
ADH5 P11766 2/20 0.40
CYP11B1 P15538 1/20 0.39
CYP11B2 P19099 1/20 0.39
HTR2A P28223 1/20 0.38
HTR2C P28335 1/20 0.38
HTR2B P41595 1/20 0.38
PDE3B Q13370 4/20 0.38
PDE3A Q14432 4/20 0.38
MTOR P42345 1/20 0.38
CRBN Q96SW2 3/20 0.38
TBXAS1 P24557 1/20 0.38
PIK3C3 Q8NEB9 1/20 0.38
JAK2 O60674 1/20 0.37
JAK1 P23458 1/20 0.37
TYK2 P29597 1/20 0.37
JAK3 P52333 1/20 0.37

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
SCHEMBL6918526 1.00 PGR (0.41) PGRYTHDF3YTHDF1YTHDF2ADH5
SCHEMBL6919141 0.99 PGR (0.42) PGRYTHDF3YTHDF1YTHDF2ADH5
SCHEMBL6924518 0.88 PGR (0.36) PGRYTHDF3YTHDF1YTHDF2ADH5
SCHEMBL6918752 0.76 PIK3C3 (0.38) YTHDF3YTHDF1YTHDF2PIK3C3JAK2
SCHEMBL6923987 0.75 PIK3C3 (0.42) YTHDF3YTHDF1YTHDF2PIK3C3JAK2
SCHEMBL6924096 0.74 PIK3C3 (0.39) YTHDF3YTHDF1YTHDF2PDE3BPDE3A
SCHEMBL6827915 0.73 CYP11B1 (0.41) PGRADH5CYP11B1CYP11B2HTR2A
SCHEMBL6827356 0.73 CD38 (0.37) PGRADH5MTORJAK2JAK1
SCHEMBL6827359 0.72 PGR (0.38) PGRADH5CYP11B1CYP11B2HTR2A
SCHEMBL6824827 0.72 PGR (0.38) PGRADH5CYP11B1CYP11B2HTR2A

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 1 patent. 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 disclosed