SCHEMBL8029033

SCHEMBL8029033

OCCCCCCNCCNCc1ccccc1

nearest known ligand 0.78

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 3/20 0.78
MAOA P21397 1/20 0.74
SIGMAR1 Q99720 6/20 0.65
MEN1 O00255 2/20 0.63
KMT2A Q03164 2/20 0.63
TDP1 Q9NUW8 1/20 0.63
SMN1; SMN2 Q16637 1/20 0.57
HDAC3 O15379 2/20 0.57
HDAC1 Q13547 2/20 0.57
HDAC2 Q92769 2/20 0.57
HDAC8 Q9BY41 2/20 0.57
NCOR2 Q9Y618 2/20 0.57

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
SCHEMBL7986745 0.98 CHRM2 (0.81) CHRM2MAOASIGMAR1MEN1KMT2A
SCHEMBL8030792 0.98 CHRM2 (0.81) CHRM2MAOASIGMAR1MEN1KMT2A
SCHEMBL8034858 0.98 CHRM2 (0.81) CHRM2MAOASIGMAR1MEN1KMT2A
SCHEMBL8032640 0.96 CHRM2 (0.78) CHRM2MAOASIGMAR1MEN1KMT2A
SCHEMBL7982481 0.96 MAOA (0.80) CHRM2MAOASIGMAR1MEN1KMT2A
SCHEMBL7984635 0.96 MAOA (0.80) CHRM2MAOASIGMAR1MEN1KMT2A
SCHEMBL8911797 0.96 MAOA (0.80) CHRM2MAOASIGMAR1MEN1KMT2A
SCHEMBL8034873 0.94 CHRM2 (0.81) CHRM2MAOASIGMAR1MEN1KMT2A
SCHEMBL1040171 0.94 MAOA (0.76) CHRM2MAOASIGMAR1MEN1KMT2A
SCHEMBL8029046 0.92 CHRM2 (0.77) CHRM2MAOASIGMAR1MEN1KMT2A

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-0797579-B1 ERYTHROMYCIN A 9-0-OXIME DERIVATIVES ENDOWED WITH ANTIBIOTIC ACTIVITY ZAMBON SPA (IT) 2000-03-15 EP disclosed
US-5847092-A Erythromycin A 9-0 oxime derivatives endowed with antibiotic activity ZAMBON GROUP S.P.A. (IT) 1998-12-08 US disclosed