SCHEMBL9053380

SCHEMBL9053380

CCN1CCN(c2cccc3ccc(Nc4ccc(Cl)cc4)cc23)CC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 3/20 0.43
CYP2C9 P11712 1/20 0.43
HTR6 P50406 1/20 0.43
CHRM1 P11229 3/20 0.42
KDM1A O60341 1/20 0.42
ADRA2A P08913 1/20 0.42
ADRA2B P18089 1/20 0.42
ADRA2C P18825 1/20 0.42
CHRM5 P08912 2/20 0.42
HTR1A P08908 1/20 0.42
HTR1D P28221 1/20 0.42
HTR1B P28222 1/20 0.42
CHRM3 P20309 1/20 0.42
LMNA P02545 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
MAPT P10636 2/20 0.41
MEN1 O00255 1/20 0.41
CYP2C19 P33261 1/20 0.41
KMT2A Q03164 1/20 0.41
NPC1 O15118 1/20 0.41

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
SCHEMBL9054002 0.92 DRD2 (0.51) HTR1AHTR1DHTR1BLMNAMAPT
SCHEMBL6308342 0.84 CHRM1 (0.62) CYP2D6CYP2C9CHRM1CHRM5CHRM3
SCHEMBL8077724 0.77 L3MBTL1 (0.39) KDM1AADRA2AADRA2BADRA2CHTR1A
SCHEMBL6305703 0.76 CHRM1 (0.53) CHRM1CHRM5HTR1AHTR1DHTR1B
SCHEMBL9275980 0.74 HTR1A (0.57) CYP2D6HTR6HTR1AHTR1DHTR1B
SCHEMBL6308077 0.72 HTR1A (0.53) CHRM1HTR1AHTR1DHTR1BLMNA
SCHEMBL6308232 0.70 RAB9A (0.55) HTR1AHTR1DHTR1BLMNAMAPT
SCHEMBL7568458 0.70 KCNH2 (0.49) CYP2D6CYP2C9KDM1AHTR1AHTR1D
SCHEMBL6418686 0.69 HTR1A (0.64) CYP2D6HTR6HTR1AHTR1DHTR1B
SCHEMBL9052843 0.68 HTR1A (0.49) CYP2D6HTR6HTR1AHTR1DHTR1B

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-0689536-A1 NAPHTHALENE DERIVATIVES PFIZER INC. (US) 1996-01-03 EP disclosed