SCHEMBL10840037

SCHEMBL10840037

CC1CNc2c(ccc(Cl)c2Cl)C1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ HTR2C P28335 14/20 0.41
▸ HTR2A P28223 10/20 0.41
▸ HTR2B P41595 8/20 0.41
▸ HTR1A P08908 2/20 0.35
▸ HTR1D P28221 2/20 0.35
▸ HTR7 P34969 2/20 0.35
▸ HTR5A P47898 2/20 0.35
▸ HRH1 P35367 1/20 0.35
▸ NOTUM Q6P988 1/20 0.34
▸ KCNH2 Q12809 1/20 0.34
▸ PNMT P11086 2/20 0.33
▸ ADRA2A P08913 1/20 0.33
▸ ADRA2B P18089 1/20 0.33
▸ ADRA2C P18825 1/20 0.33
▸ DRD2 P14416 2/20 0.32
▸ DRD3 P35462 2/20 0.32
▸ ADRB1 P08588 1/20 0.32

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
SCHEMBL28994087 0.84 HTR2C (0.42) HTR2CHTR2AHTR2BKCNH2
SCHEMBL21692939 0.70 HTR2C (0.41) HTR2CHTR2AHTR2BHTR5AADRB1
SCHEMBL20910802 0.70 — —
SCHEMBL26178858 0.69 HTR2C (0.41) HTR2CHTR2AHTR2BNOTUMPNMT
SCHEMBL13075669 0.69 MAOA (0.40) HTR1ADRD2DRD3
SCHEMBL7797306 0.69 MEN1 (0.36) HTR5AADRA2C
SCHEMBL20912271 0.69 ALDH1A1 (0.40) HTR2AHTR1AHTR1DHTR7HTR5A
SCHEMBL22791317 0.68 HTR2C (0.42) HTR2CHTR2AHTR2BHTR1AHTR5A
SCHEMBL8986766 0.68 BRD4 (0.34) —
SCHEMBL8986760 0.68 BRD4 (0.34) —

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-0198264-A2 Carbamoyl imidazoles NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) 1986-10-22 — — EP disclosed
Send feedback