SCHEMBL11244546

SCHEMBL11244546

CCN(CC)c1ccc(C2(N(c3ccccc3)c3ccc(OC(C)C)cc3)OC(=O)c3cccnc32)cc1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 1/20 0.41
FFAR4 Q5NUL3 1/20 0.36
GHSR Q92847 2/20 0.33
GPR88 Q9GZN0 2/20 0.33
CHRM5 P08912 1/20 0.33
EDNRB P24530 1/20 0.33
EDNRA P25101 1/20 0.33
EGLN1 Q9GZT9 1/20 0.33
MAOB P27338 1/20 0.32
KMT2A Q03164 3/20 0.32
MEN1 O00255 1/20 0.32
GAA P10253 1/20 0.32
RAB9A P51151 1/20 0.32
NPY5R Q15761 2/20 0.32
NOX1 Q9Y5S8 1/20 0.31
TP53 P04637 2/20 0.31
POLB P06746 1/20 0.31
MAPT P10636 1/20 0.31

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
SCHEMBL11374754 0.90 KMT2A (0.38) GHSRKMT2AMEN1GAARAB9A
SCHEMBL11241792 0.88 CNR2 (0.41) CNR2GHSRGPR88CHRM5EDNRB
SCHEMBL11239691 0.83 ALDH1A1 (0.38) GHSRKMT2AMEN1GAARAB9A
SCHEMBL11244555 0.80 CNR2 (0.36) CNR2FFAR4GHSRGPR88EGLN1
SCHEMBL11248616 0.79 ALDH1A1 (0.40) KMT2AMEN1RAB9ANPY5RTP53
SCHEMBL11235691 0.77 CNR2 (0.36) CNR2FFAR4GPR88EGLN1KMT2A
SCHEMBL11244078 0.77 MEN1 (0.36) CNR2GHSRKMT2AMEN1GAA
SCHEMBL11382459 0.77 CNR2 (0.39) CNR2CHRM5KMT2AMEN1TP53
SCHEMBL11240578 0.76 CYP3A4 (0.36) FFAR4KMT2AMEN1RAB9ANPY5R
SCHEMBL11365552 0.74 ATM (0.42) CHRM5KMT2AMEN1GAATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4337340-A FROM DIPHENYLAMINES AND BENZOYL OR 3-INDOLYLCARBONYL PYRIDINE- OR PYRAZINECARBOXYLIC ACIDS STERLING DRUG INC. (US) 1982-06-29 US disclosed
US-4243250-A FUROPYRIDINONES OR FUROPYRAZINONES AS COLOR FORMERS STERLING DRUG INC. (US) 1981-01-06 US disclosed
US-4211872-A COLOR FORMERS FREEDOM CHEMICAL COMPANY 1980-07-08 US disclosed