SCHEMBL10595263

SCHEMBL10595263

CN(CCC1c2ccccc2Oc2ccccc21)C1CCOc2ccccc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.41
CYP2D6 P10635 1/20 0.41
HTR2A P28223 6/20 0.38
HRH1 P35367 4/20 0.38
SSTR1 P30872 2/20 0.37
SSTR4 P31391 2/20 0.37
SSTR3 P32745 2/20 0.37
DRD2 P14416 1/20 0.37
DRD4 P21917 1/20 0.37
SSTR2 P30874 1/20 0.37
SSTR5 P35346 1/20 0.37
HTR2C P28335 4/20 0.36
NPSR1 Q6W5P4 2/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
TSHR P16473 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
ALDH1A1 P00352 1/20 0.34
USP2 O75604 1/20 0.34
MAOA P21397 2/20 0.33

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
SCHEMBL7507128 0.80 HTR2A (0.39) CYP1A2CYP2D6HTR2AHRH1HTR2C
SCHEMBL12124884 0.79 SLC6A2 (0.39) HTR2AHRH1SSTR4HTR2CMEN1
SCHEMBL12608420 0.78 MAOA (0.36) HTR2AHRH1SSTR4HTR2CMEN1
SCHEMBL1132995 0.78 HTR2A (0.37) CYP1A2CYP2D6HTR2AHRH1SSTR4
SCHEMBL12565935 0.77 SSTR4 (0.37) HTR2AHRH1SSTR4HTR2CMAOA
SCHEMBL7503701 0.75 ABCB1 (0.41)
SCHEMBL803154 0.75 ITGB2 (0.41) SMN1; SMN2
SCHEMBL7503754 0.73 TMEM97 (0.38) MEN1KMT2AMAOA
SCHEMBL7547914 0.70 ALDH1A1 (0.41) HTR2AHRH1DRD2MEN1KMT2A
SCHEMBL10595268 0.68 HTR1A (0.44) HTR2AHRH1DRD2MAOAMAOB

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
JP-1146876-A None JP disclosed
JP-H01146876-A AMINOALKYLBENZOPYRAN DERIVATIVE DAI ICHI SEIYAKU CO LTD 1989-06-08 JP disclosed