SCHEMBL11292500

SCHEMBL11292500

NCCN(P(c1ccccc1)c1ccccc1)P(c1ccccc1)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CARM1 Q86X55 1/20 0.42
PRMT6 Q96LA8 1/20 0.42
PRMT8 Q9NR22 1/20 0.42
CYP3A4 P08684 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
HTR2A P28223 4/20 0.37
TAAR1 Q96RJ0 3/20 0.37
LOXL2 Q9Y4K0 2/20 0.37
CYP2A6 P11509 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
HRH1 P35367 2/20 0.34
MAOA P21397 1/20 0.33
ADRA2C P18825 1/20 0.32
AOC3 Q16853 1/20 0.31
KIF11 P52732 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
SCHEMBL19530997 0.87 CYP3A4 (0.43) CYP3A4TDP1HTR2ATAAR1HRH1
SCHEMBL10298220 0.79 TDP1 (0.36) CYP3A4TDP1
SCHEMBL2359631 0.79 TP53 (0.36) CYP3A4TDP1SMN1; SMN2
SCHEMBL17190349 0.77 TAAR1 (0.45) HTR2ATAAR1SMN1; SMN2HRH1
SCHEMBL17598759 0.76 TDP1 (0.43) TDP1
SCHEMBL17190348 0.74 HTR2A (0.46) HTR2ATAAR1HRH1
SCHEMBL17190352 0.74 SIGMAR1 (0.43) CYP3A4HTR2ASMN1; SMN2HRH1ADRA2C
SCHEMBL9864179 0.73 CYP3A4 (0.39) CYP3A4TDP1AOC3
SCHEMBL10314926 0.73 KCNH2 (0.46) TDP1
SCHEMBL17190351 0.73 LTA4H (0.39) CYP3A4TDP1HTR2AHRH1

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
US-4328364-A RHODIUM CATALYST SNAMPROGETTI, S.P.A. (IT) 1982-05-04 US disclosed
US-4239914-A Process for preparing 2-(6'-methoxy-2'-naphthyl)-propionic acid MONTEDISON S.P.A. (IT) 1980-12-16 US disclosed