SCHEMBL14363772

SCHEMBL14363772

CC1OCC2c3c(c4ccccc4n3C)CCN12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC6A4 P31645 1/20 0.43
▸ MEN1 O00255 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ CYP1A2 P05177 1/20 0.39
▸ CYP2D6 P10635 1/20 0.39
▸ HTR2A P28223 1/20 0.37
▸ HTR2C P28335 1/20 0.37
▸ MAOA P21397 4/20 0.36
▸ ALOX15 P16050 2/20 0.36
▸ MAPK1 P28482 2/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ MAPT P10636 1/20 0.35
▸ GPR3 P46089 1/20 0.35
▸ ADRA1A P35348 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ TSHR P16473 1/20 0.35
▸ MAOB P27338 2/20 0.34
▸ HTR5A P47898 2/20 0.34
▸ ABCB1 P08183 1/20 0.34

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
SCHEMBL14363775 0.84 SLC6A4 (0.41) SLC6A4MEN1KMT2ACYP1A2CYP2D6
SCHEMBL14363778 0.84 SLC6A4 (0.39) SLC6A4MEN1KMT2ACYP1A2CYP2D6
SCHEMBL14363768 0.81 SLC6A4 (0.48) SLC6A4MEN1KMT2AMAOAKDM4E
SCHEMBL14363769 0.78 SMPD1 (0.41) SLC6A4MEN1KMT2ACYP1A2MAPK1
SCHEMBL13877240 0.73 SLC6A4 (0.46) SLC6A4MEN1KMT2ACYP1A2CYP2D6
SCHEMBL3858428 0.71 MCHR1 (0.52) SLC6A4CYP1A2CYP2D6ADRA1ATSHR
SCHEMBL14364159 0.71 CHRNA7 (0.55) SLC6A4MEN1KMT2ACYP1A2CYP2D6
SCHEMBL3857346 0.70 MCHR1 (0.52) SLC6A4CYP1A2CYP2D6ADRA1ATSHR
SCHEMBL13877239 0.69 SLC6A4 (0.43) SLC6A4MEN1KMT2ACYP1A2CYP2D6
SCHEMBL14627593 0.69 SLC6A4 (0.48) SLC6A4CYP1A2CYP2D6HTR2AHTR2C

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-2007147819-A1 3H,11H-OXAZOLO[3',4':1,2]PYRIDO[3,4-B]INDOLE DERIVATIVES AND THERAPEUTIC USE THEREOF FOURTILLAN (FR) 2007-12-27 — — WO disclosed
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