SCHEMBL8656607

SCHEMBL8656607

COc1ccc(-c2c[nH]c(CCCCN)n2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.43
HRH2 P25021 1/20 0.42
HRH3 Q9Y5N1 1/20 0.42
PDGFRB P09619 1/20 0.41
NPC1 O15118 3/20 0.40
RAB9A P51151 3/20 0.40
MAPT P10636 3/20 0.40
ALDH1A1 P00352 2/20 0.40
POLB P06746 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CASP3 P42574 1/20 0.40
SENP8 Q96LD8 1/20 0.40
SENP7 Q9BQF6 1/20 0.40
SENP6 Q9GZR1 1/20 0.40
DYRK1A Q13627 1/20 0.39
SYK P43405 4/20 0.39
TAAR1 Q96RJ0 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
MAPK1 P28482 2/20 0.38

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
SCHEMBL8655680 0.85 MAOB (0.47) MAOBPDGFRBDYRK1ASYKTAAR1
SCHEMBL10886759 0.84 PDGFRB (0.46) MAOBHRH2HRH3PDGFRBNPC1
SCHEMBL8655655 0.83 SLC7A5 (0.39) NPC1RAB9AMAPTALDH1A1
SCHEMBL4861236 0.82 LOXL2 (0.42) PDGFRBMAPTMAPK1
SCHEMBL8091110 0.81 MAOB (0.38) MAOBHRH2HRH3PDGFRBSYK
SCHEMBL8656924 0.81 MPO (0.41) MAOBHRH2HRH3RAB9AALDH1A1
SCHEMBL5674038 0.81 MAOA (0.43) HRH2HRH3SMN1; SMN2TAAR1TLR8
SCHEMBL5673490 0.80 HRH1 (0.46) HRH2HRH3
SCHEMBL1927324 0.80 MAOA (0.42) HRH2HRH3MAPTTAAR1TLR8
SCHEMBL11048397 0.79 PDGFRB (0.47) PDGFRBNPC1RAB9AMAPTALDH1A1

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
EP-0680967-B1 Erythromycin derivatives, their process of preparation and their use as medicaments HOECHST MARION ROUSSEL INC (FR) 1998-10-14 EP claimed