SCHEMBL16103152

SCHEMBL16103152

CCN(C(=O)c1cc(Cl)c(N)c2cccnc12)C(C)C1(F)CCNCC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR3E A5X5Y0 2/20 0.40
HTR3B O95264 2/20 0.40
HTR3A P46098 2/20 0.40
HTR3D Q70Z44 2/20 0.40
HTR3C Q8WXA8 2/20 0.40
KDM4E B2RXH2 2/20 0.35
TMEM97 Q5BJF2 4/20 0.33
SIGMAR1 Q99720 4/20 0.33
L3MBTL1 Q9Y468 3/20 0.33
NPC1 O15118 3/20 0.33
RAB9A P51151 3/20 0.33
OPRK1 P41145 2/20 0.33
CHRM2 P08172 1/20 0.33
ADRB1 P08588 1/20 0.33
ADRA2A P08913 1/20 0.33
CHRM1 P11229 1/20 0.33
ADRA2B P18089 1/20 0.33
CHRM3 P20309 1/20 0.33
DRD1 P21728 1/20 0.33
DRD5 P21918 1/20 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
SCHEMBL16097832 0.74 HTR3E (0.49) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL18094615 0.73 HTR3E (0.45) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL16103357 0.71 HTR3E (0.50) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL10643748 0.70 SMN1; SMN2 (0.38) OPRK1OPRM1OPRD1
SCHEMBL16102965 0.68 HTR3E (0.43) HTR3EHTR3BHTR3AHTR3DHTR3C
Hydrochloric Acid SCHEMBL16097868 0.68 HTR3E (0.43) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL20118919 0.67 HAVCR2 (0.55) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL18094599 0.66 HTR3E (0.64) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL16098023 0.66 HTR3A (0.56) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL16098630 0.66 HTR3E (0.45) HTR3EHTR3BHTR3AHTR3DHTR3C

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-2976337-A1 5-AMINO-QUINOLINE-8-CARBOXAMIDE DERIVATIVES AS 5-HT4 RECEPTOR AGONISTS Suven Life Sciences Limited (IN) 2016-01-27 EP disclosed
WO-2014147636-A1 5-AMINO-QUINOLINE-8-CARBOXAMIDE DERIVATIVES AS 5-HT4 RECEPTOR AGONISTS SUVEN LIFE SCIENCES LIMITED (IN) 2014-09-25 WO disclosed