SCHEMBL6919141

SCHEMBL6919141

O=c1cc(-n2ccnc2)cc(C2CCCC2)[nH]1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PGR P06401 1/20 0.42
YTHDF3 Q7Z739 1/20 0.41
YTHDF1 Q9BYJ9 1/20 0.41
YTHDF2 Q9Y5A9 1/20 0.41
CYP11B1 P15538 1/20 0.39
CYP11B2 P19099 1/20 0.39
HTR2A P28223 1/20 0.39
HTR2C P28335 1/20 0.39
HTR2B P41595 1/20 0.39
ADH5 P11766 2/20 0.39
PDE3B Q13370 5/20 0.39
PDE3A Q14432 5/20 0.39
CRBN Q96SW2 3/20 0.39
TBXAS1 P24557 1/20 0.39
PIK3C3 Q8NEB9 1/20 0.38
IDO1 P14902 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 0.99 PGR (0.41) PGRYTHDF3YTHDF1YTHDF2CYP11B1
SCHEMBL6920616 0.99 PGR (0.41) PGRYTHDF3YTHDF1YTHDF2CYP11B1
SCHEMBL6924518 0.87 PGR (0.36) PGRYTHDF3YTHDF1YTHDF2CYP11B1
SCHEMBL6918752 0.74 PIK3C3 (0.38) YTHDF3YTHDF1YTHDF2PIK3C3
SCHEMBL6923987 0.73 PIK3C3 (0.42) YTHDF3YTHDF1YTHDF2PIK3C3
SCHEMBL6924096 0.72 PIK3C3 (0.39) YTHDF3YTHDF1YTHDF2PDE3BPDE3A
SCHEMBL6827087 0.71 PGR (0.39) PGRCYP11B1CYP11B2HTR2AHTR2C
SCHEMBL6827915 0.71 CYP11B1 (0.41) PGRCYP11B1CYP11B2HTR2AHTR2C
SCHEMBL6827356 0.71 CD38 (0.37) PGRADH5IDO1
SCHEMBL6827359 0.70 PGR (0.38) PGRCYP11B1CYP11B2HTR2AHTR2C

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